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pNA (p-nitroaniline) - ≥99%, high purity , CAS No.100-01-6

    Grade & Purity:
  • ≥99%
In stock
Item Number
P276604
Grouped product items
SKU Size
Availability
Price Qty
P276604-100mg
100mg
3
$85.90

Solvatochromic dye

Basic Description

Synonyms DTXSID8020961 | InChI=1/C6H6N2O2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H,7H | NCGC00091426-02 | 4-Nitroaniline, >=99% | Fast Red GG Salt | MFCD00007858 | Nitrazol CF extra | p-Nitroaniline | Fast Red Salt 2J | Red 2G Base | SMR001372024 | 4-Nitroaniline, 99% | CHEB
Specifications & Purity ≥99%
Biochemical and Physiological Mechanisms Solvatochromic dye. UV-visual peak position changes with the balance of hydrogen bonding acceptors and donors in the solvent. Reacts to form a purple azo dye. Undergoes photocatalytic degradation in the presence of TiO 2 suspensions.
Storage Temp Store at -20°C,Desiccated
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Note Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.
Product Description

Store at -20°C. Store under desiccating conditions. The product can be stored for up to 12 months.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Benzenoids
Class Benzene and substituted derivatives
Subclass Nitrobenzenes
Intermediate Tree Nodes Not available
Direct Parent Nitrobenzenes
Alternative Parents Nitroaromatic compounds  Aniline and substituted anilines  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Primary amines  Organopnictogen compounds  Organic zwitterions  Organic oxides  Hydrocarbon derivatives  
Molecular Framework Aromatic homomonocyclic compounds
Substituents Nitrobenzene - Nitroaromatic compound - Aniline or substituted anilines - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Organic zwitterion - Primary amine - Organonitrogen compound - Amine - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors a small molecule

Associated Targets(Human)

ESR1 Tclin Estrogen receptor alpha (17718 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
NR3C1 Tclin Glucocorticoid receptor (14987 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
AR Tclin Androgen Receptor (11781 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CYP1B1 Tchem Cytochrome P450 1B1 (1148 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CYP1A1 Tchem Cytochrome P450 1A1 (1169 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
GLP1R Tclin Glucagon-like peptide 1 receptor (111429 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Lymphoblastoid cell (5959 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
GMNN Tbio Geminin (128009 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
BAZ2B Tchem Bromodomain adjacent to zinc finger domain protein 2B (56204 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
ATXN2 Tbio Ataxin-2 (54410 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

PREP Prolyl endopeptidase (14 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Plasmodium falciparum (966862 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
GCN5 Histone acetyltransferase GCN5 (89 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Colon (26 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
TGR Thioredoxin glutathione reductase (28579 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Rorc Nuclear receptor ROR-gamma (89407 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

IUPAC Name 4-nitroaniline
INCHI InChI=1S/C6H6N2O2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H,7H2
InChIKey TYMLOMAKGOJONV-UHFFFAOYSA-N
Smiles C1=CC(=CC=C1N)[N+](=O)[O-]
Isomeric SMILES C1=CC(=CC=C1N)[N+](=O)[O-]
WGK Germany 2
RTECS BY7000000
UN Number 1661
Packing Group II
Molecular Weight 138.12
Beilstein 508690
Reaxy-Rn 508690
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=508690&ln=

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

1 results found

Lot Number Certificate Type Date Item
A2220209 Certificate of Analysis Jan 25, 2022 P276604

Chemical and Physical Properties

Solubility Soluble in ethanol to 100 mM and in DMSO
Sensitivity moisture sensitive
Flash Point(°C) 199 °C
Boil Point(°C) 332 °C
Melt Point(°C) 146°C
Molecular Weight 138.120 g/mol
XLogP3 1.400
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 138.043 Da
Monoisotopic Mass 138.043 Da
Topological Polar Surface Area 71.800 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 124.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Citations of This Product

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66. Yan-Zhen Liu, Yong-Feng Li, Shu-Xia Yuan, Shuai Chen, Cong-Wei Wang, Xiao-Ming Li, Fang-Yuan Su, Cheng-Meng Chen.  (2018)  Synthesis of 3D N, S Dual-Doped Porous Carbons with Ultrahigh Surface Areas for Highly Efficient Oxygen Reduction Reactions.  ChemElectroChem,  (22): (3506-3513). 
67. Yanhua Yang, Hang Lu, Juqing Liu, Yingzhong Shen.  (2018)  Synthesis and binary/ternary write-once read-many-times electrical memory behaviors of carbazole-based polyimides bearing flexible linkage segment.  EUROPEAN POLYMER JOURNAL,  108  (10). 
68. Chenyue Zhan, Jiatian Cheng, Bowen Li, Shuailing Huang, Fang Zeng, Shuizhu Wu.  (2018)  A Fluorescent Probe for Early Detection of Melanoma and Its Metastasis by Specifically Imaging Tyrosinase Activity in a Mouse Model.  ANALYTICAL CHEMISTRY,  90  (15): (8807–8815). 
69. Yuyan Xiao, Xirong Huang.  (2018)  The physicochemical properties of a room-temperature liquidus binary ionic liquid mixture of [HNMP][CH3SO3]/[Bmim]Cl and its application for fructose conversion to 5-hydroxymethylfurfural.  RSC Advances,  (34): (18784-18791). 
70. Yuqi Ke, Wenbin Jin, Qiwei Yang, Xian Suo, Yiwen Yang, Qilong Ren, Huabin Xing.  (2018)  Nanostructured Branched-Chain Carboxylate Ionic Liquids: Synthesis, Characterization, and Extraordinary Solubility for Bioactive Molecules.  ACS Sustainable Chemistry & Engineering,  (7): (8983–8991). 
71. Fajun Wang, Jinpei Huang, Jianhong Xu.  (2018)  Continuous-flow synthesis of azo dyes in a microreactor system.  Chemical Engineering and Processing-Process Intensification,  127  (43). 
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73. Qiaochu Zhang, Meiling Qi, Jinliang Wang.  (2017)  Star-shaped oligothiophene-functionalized truxene materials as stationary phases for capillary gas chromatography.  JOURNAL OF CHROMATOGRAPHY A,  1525  (152). 
74. Zhe Xu, Ruonan Liu, Huashi Guan.  (2017)  Dual-target inhibitor screening against thrombin and factor Xa simultaneously by mass spectrometry.  ANALYTICA CHIMICA ACTA,  990  (1). 
75. Lu-Liang Wang, Cheng-Xiong Yang, Xiu-Ping Yan.  (2017)  In Situ Growth of Covalent Organic Framework Shells on Silica Microspheres for Application in Liquid Chromatography.  ChemPlusChem,  82  (6): (933-938). 
76. Yong Zhang, Tao Yue, Hongliang Cao, Yun Gao, Weian Zhang.  (2017)  Photocontrollable Supramolecular Self-Assembly of a Porphyrin Derivative that Contains a Polyhedral Oligomeric Silsesquioxane (POSS).  Asian Journal of Organic Chemistry,  (8): (1034-1042). 
77. Shengxin Chen, Ruixia Liu, Yajing Li, Ruirui Zhang, Cong Zhao, Hongguo Tang, Congzhen Qiao, Suojiag Zhang.  (2017)  Relationship of basicity and hydrogen bond properties of ionic liquids with its catalytic performance: Application to synthesis of propylene glycol methyl ether.  CATALYSIS COMMUNICATIONS,  96  (69). 
78. Yong Cheng, Feifei Sun, Qichun Feng, Qiang Zhao, Yinghua Zhou.  (2017)  In situ synthesis of AgNPs@Ag(I)-AMTD metal-organic gel composite and its catalytic properties.  COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS,  522  (43). 
79. Changhua Song, Sijie Liu, Xinwen Peng, Jinxing Long, Wenyong Lou, Xuehui Li.  (2016)  Catalytic Conversion of Carbohydrates to Levulinate Ester over Heteropolyanion-Based Ionic Liquids.  ChemSusChem,  (23): (3307-3316). 
80. Jiao Jiao, Haiyan Wang, Wanchun Guo, Ruifei Li, Kesong Tian, Zhaopeng Xu, Yin Jia, Yuehao Wu, Ling Cao.  (2016)  In Situ Confined Growth Based on a Self-Templating Reduction Strategy of Highly Dispersed Ni Nanoparticles in Hierarchical Yolk–Shell Fe@SiO2 Structures as Efficient Catalysts.  Chemistry-An Asian Journal,  11  (24): (3534-3540). 
81. Zhao Jie, Xie Yu, Fang Jing, Ling Yun, Gao Yunhua, Liu Xiaoming, Zhang Qiugen, Xu Qiuhua, Xiong Hui.  (2016)  P-phenylenediamine-benzoquinone Schiff base Ag(I) complexes chemically bonded to few-layered graphene as flexible materials for electromagnetic studies.  JOURNAL OF MATERIALS SCIENCE,  51  (23): (10574-10584). 
82. Huajun Zhao, Qiujun Wang, Yonghong Deng, Qiao Shi, Yong Qian, Bingbing Wang, Lei Lü, Xueqing Qiu.  (2016)  Preparation of renewable lignin-derived nitrogen-doped carbon nanospheres as anodes for lithium-ion batteries.  RSC Advances,  (81): (77143-77150). 
83. Hao Fang, Ming Wen, Hanxing Chen, Qingsheng Wu, Weiying Li.  (2015)  Graphene stabilized ultra-small CuNi nanocomposite with high activity and recyclability toward catalysing the reduction of aromatic nitro-compounds.  Nanoscale,  (1): (536-542). 
84. Wanchun Guo, Jiao Jiao, Kesong Tian, Yongfu Tang, Yin Jia, Ruifei Li, Zhaopeng Xu, Haiyan Wang.  (2015)  Controllable synthesis of core–satellite Fe3O4@polypyrrole/Pd nanoarchitectures with aggregation-free Pd nanocrystals confined into polypyrrole satellites as magnetically recoverable and highly efficient heterogeneous catalysts.  RSC Advances,  (124): (102210-102218). 
85. Kangming Xiong, Fangjun Huo, Caixia Yin, Yueying Chu, Yutao Yang, Jianbin Chao, Anmin Zheng.  (2016)  A novel recognition mechanism supported by experiment and theoretical calculation for hypochlorites recognition and its practical application.  SENSORS AND ACTUATORS B-CHEMICAL,  224  (307). 
86. Yonghong Deng, Youfa Liu, Yong Qian, Weijian Zhang, Xueqing Qiu.  (2015)  Preparation of Photoresponsive Azo Polymers Based on Lignin, a Renewable Biomass Resource.  ACS Sustainable Chemistry & Engineering,  (6): (1111–1116). 
87. Shi Chaohong, Zhu Nengwu, Cao Yanlan, Wu Pingxiao.  (2015)  Biosynthesis of gold nanoparticles assisted by the intracellular protein extract of Pycnoporus sanguineus and its catalysis in degradation of 4-nitroaniline.  Nanoscale Research Letters,  10  (1): (1-8). 
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90. Wenbin Shi, Linjun Zhang, Jie Deng, Dongsheng Wang, Shudong Sun, Weifeng Zhao, Changsheng Zhao.  (2015)  Redox-responsive polymeric membranes via supermolecular host–guest interactions.  JOURNAL OF MEMBRANE SCIENCE,  480  (139). 
91. Jun-Hui Zhang, Sheng-Ming Xie, Mei Zhang, Min Zi, Pin-Gang He, Li-Ming Yuan.  (2014)  Novel Inorganic Mesoporous Material with Chiral Nematic Structure Derived from Nanocrystalline Cellulose for High-Resolution Gas Chromatographic Separations.  ANALYTICAL CHEMISTRY,  86  (19): (9595–9602). 
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96. Qin Chen, Wenjun Xiao, Lilong Zhou, Tinghua Wu, Ying Wu.  (2012)  Hydrolysis of chitosan under microwave irradiation in ionic liquids promoted by sulfonic acid-functionalized ionic liquids.  POLYMER DEGRADATION AND STABILITY,  97  (49). 
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101. Qingshan Zhao, Dejian Xu, Libo Wang, Shihao Cui, Qinlian Liu, Xuan Han, Zhiyuan Wang, Hui Ning, Mingbo Wu.  (2025)  A core-shell confinement strategy towards single-atom Fe-N/S-C bifunctional catalyst for selective nitroarene reduction and olefin epoxidation.  JOURNAL OF ALLOYS AND COMPOUNDS,  1012  (178488). 
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106. Xing Long, Mingzhu Yao, Shaoyan Wang, Chuangqi Ren, Xiao Zhao, Chengrong Qin, Chen Liang, Caoxing Huang, Shuangquan Yao.  (2024)  Efficient separation of poplar lignin by a new carboxylic acid based eutectic solvent—choline chloride/malonic acid.  ChemSusChem,    (e202402345). 
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108. Jiale Wu, Jiajun Zhang, Liguo Wang, Ziqiang Han, Xiang Hui, Yan Cao, Jianhui Shi, Shuang Xu, Peng He, Huiquan Li.  (2024)  Enhanced tandem hydrogenation of nitroaromatics to alicyclic amines via Pt-Ru synergistic catalysis.  CHEMICAL ENGINEERING JOURNAL,  488  (151083). 
109. Qian Guo, Ziyun Su, Dong Xiang, Beirong Yu, Di Wang, Youjun Fan, Fuqin Zheng, Wei Chen.  (2024)  Fabrication of six-atom Pd clusters regulated with different short ligands and their surface structure-dependent catalytic activities.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,  662  (242). 
110. Yuhui Ci, Yunqian Ma, Tianying Chen, Feiyun Li, Yanjun Tang.  (2024)  Facile dissolution of cellulose by superbase-derived ionic liquid using organic solvents as co-solvents at mild temperatures.  CARBOHYDRATE POLYMERS,  330  (121836). 
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113. Zhuoqin Li, Minghui Ma, Zhiyin Xiao, Xiujuan Jiang, Xinlei Xu, Hailong Wang, Peter C. Ford, Xiaoming Liu.  (2024)  Increasing the CO-Release Photosensitivity of Mn(I) Carbonyl Complexes Towards Longer Wavelengths by Electronically Tuning Their Schiff Base Ligands.  APPLIED ORGANOMETALLIC CHEMISTRY,  39  (1): (e7959). 
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115. Ke Yuan, Tao Zhang, Li Lv, Yan Wang, Zongpeng Zou, Shengwei Tang.  (2024)  Intensification Mechanism of Acidic Imidazole-Based Ionic Liquids on the Synthesis of 1,3,5-Trioxane Catalyzed by Sulfuric Acid.  INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,  63  (28): (12440-12451). 
116. Xiaoli Wu, Xingya Huang, Yongzheng Wang, Jingjing Chen, Ye Wan, Jianhua Liu, Wenpeng Li, Jingtao Wang.  (2024)  Investigating molecule transport behaviors in two-dimensional nanochannels with adjusted interlayer spacing.  JOURNAL OF MEMBRANE SCIENCE,    (123658). 
117. Bingjie Wang, Pengfei Jiang, Lihua Zhang, Zhaogai Wang, Wei Zong.  (2025)  Key enzymes, physicochemical properties and volatile compounds in garlic (Allium sativum L.) cloves at different storage temperatures.  Food Bioscience,    (105881). 
118. Wenyu Gao, Guanying Shi, Lihua Zhang, Zhaogai Wang, Wei Zong.  (2025)  Optimization of fermentation conditions for producing γ–glutamyl transpeptidase by Bacillus licheniformis and enzymatic synthesis of characteristic volatile sulfur-containing compounds in Toona sinensis.  BIOCHEMICAL ENGINEERING JOURNAL,  215  (109628). 
119. Sisi Yao, Dengkang Guo, Shenjie Han, Zongying Fu, Shaoyi Lyu, Jingpeng Li, Yun Lu.  (2024)  Polydopamine-assisted immobilization of metallic nanoparticles confined regionally in bamboo microchannels as continuous-flow microreactors for enhanced catalysis.  CHEMICAL ENGINEERING JOURNAL,  492  (152327). 
120. Zhendong Zhang, Jing Xiao, Chunyou Wang, Fangmiao Song, Wei Sun, Chenhui Wang, Zhisong Lu, Yan Zhang.  (2024)  Polydopamine-mediated in situ synthesis of gold nanoparticles uniformly distributed on silk fibers as reusable catalysts for efficient 4-nitrophenol reduction.  Journal of Industrial Textiles,     
121. Guanying Shi, Wenyu Gao, Zuobing Xiao, Le Zhang, Pengfei Jiang, Lili Zhao, Zhaogai Wang, Zhimin Xu.  (2024)  Purification and Characterization of γ-Glutamyl Transpeptidase from Toona sinensisand Its Function on Formation of Sulfur-Containing Volatiles.  JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,  72  (47): (26376-26383). 
122. Yu Chen, Yaxue Shen, Zhuojia Shi, Ziyang Zhang, Qing Zhang, Yanlong Wang, Minghui Feng, Chenyang Wang.  (2025)  Recovery of all-solid-state sodium-ion batteries cathode and solid electrolyte using deep eutectic solvents as green solvents.  SEPARATION AND PURIFICATION TECHNOLOGY,  359  (130473). 
123. Yu Chen, Zhuojia Shi, Xueqing Zhang, Chenyang Wang, Yanlong Wang, Zihang Niu, Yuqing Zhang, Minghui Feng.  (2024)  Recycling Solid Electrolytes from All-Solid-State Lithium-Ion Batteries by Using Deep Eutectic Solvents as Green Extractants.  ChemSusChem,    (e202402126). 
124. Gege Zhao, Haoyu Xu, Hai Zhang, Hong Zhang, Yanlan Bi, Xuebing Xu.  (2024)  Removal and mechanism investigation of polycyclic aromatic hydrocarbons in coconut oils by ionic liquids.  JOURNAL OF THE AMERICAN OIL CHEMISTS SOCIETY,     
125. Hong Tu, Ying Xu, Shun-shun Chen, Ya Wang, Sheng-xin Guo, Jian Wu.  (2024)  Screening of Ultra-Efficient Visible Light Catalysts via Material Modification to Activate Electron Polarization Inside the Material.  Advanced Energy and Sustainability Research,    (2400175). 
126. Zhaogai Wang, Lili Zhao, Pengfei Jiang, Guanying Shi, Le Zhang, Wenkui Zhu, Zhimin Xu.  (2024)  Sensory properties of rehydrated Toona sinensis shoots after dehydrated by different drying methods and association with gamma-glutamyl transferase reaction.  FOOD CHEMISTRY,  448  (139075). 
127. Wulan Zeng, Daiyao Yue, Xia Wang, Haiyun Li, Xiangjun Kong.  (2025)  Synthesis, structural, spectroscopic investigation, Hirshfeld surface analysis and DFT calculation of a new spiro compound including 4-nitroaniline moiety.  JOURNAL OF MOLECULAR STRUCTURE,  1322  (140371). 
128. Yanan Zhao, Liang Ma, Fengxia Wang, Mingfang Zhang, Yuxin Song, Huan Xing, Guang Yang.  (2024)  The Fabrication of Supramolecular Gel Based on Cholesterol-Substituted Azobenzene and its Multiple Applications.  ChemistrySelect,  (33): (e202402404). 

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