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3-Hydroxybenzoic acid - 98%, high purity , CAS No.99-06-9

    Grade & Purity:
  • ≥98%
In stock
Item Number
H104349
Grouped product items
SKU Size
Availability
Price Qty
H104349-25g
25g
5
$19.90
H104349-100g
100g
5
$42.90
H104349-500g
500g
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$159.90

Basic Description

Synonyms meta-hydroxybenzoate | 713EC407-4844-477D-8207-DBD66E398D2C | C00587 | 3-Carboxyphenol | NSC55746 | NSC-55746 | m-salicylate | NCGC00248676-01 | EINECS 202-726-5 | PD144440 | SCHEMBL40078 | EN300-17318 | HY-W004049 | Tox21_200527 | BDBM50336491 | 3-Hydrox
Specifications & Purity ≥98%
Storage Temp Protected from light
Shipped In Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Benzenoids
Class Benzene and substituted derivatives
Subclass Benzoic acids and derivatives
Intermediate Tree Nodes Not available
Direct Parent Hydroxybenzoic acid derivatives
Alternative Parents Benzoic acids  Benzoyl derivatives  1-hydroxy-4-unsubstituted benzenoids  1-hydroxy-2-unsubstituted benzenoids  Monocarboxylic acids and derivatives  Carboxylic acids  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular Framework Aromatic homomonocyclic compounds
Substituents Hydroxybenzoic acid - Benzoic acid - Benzoyl - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
Description This compound belongs to the class of organic compounds known as hydroxybenzoic acid derivatives. These are compounds containing a hydroxybenzoic acid (or a derivative), which is a benzene ring bearing a carboxyl and a hydroxyl groups.
External Descriptors monohydroxybenzoic acid

Associated Targets(Human)

CA2 Tclin Carbonic anhydrase 2 (1 Activities)
Activity Type Activity Value -log(M) Mechanism of Action Activity Reference Publications (PubMed IDs)
CA2 Tclin Carbonic anhydrase II (17698 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
VDR Tclin Vitamin D receptor (26531 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CA6 Tclin Carbonic anhydrase VI (993 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CA1 Tclin Carbonic anhydrase I (13240 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
NEU3 Tchem Sialidase 3 (398 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CA12 Tclin Carbonic anhydrase XII (6231 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CA9 Tclin Carbonic anhydrase IX (8255 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

Ptpn1 Protein-tyrosine phosphatase 1B (270 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Hcar2 Hydroxycarboxylic acid receptor 2 (55 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Carbonic anhydrase (69 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Ralstonia solanacearum (520 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Saccharomyces cerevisiae (19171 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Mus musculus (284745 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

Pubchem Sid 488180421
Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488180421
IUPAC Name 3-hydroxybenzoic acid
INCHI InChI=1S/C7H6O3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,8H,(H,9,10)
InChIKey IJFXRHURBJZNAO-UHFFFAOYSA-N
Smiles C1=CC(=CC(=C1)O)C(=O)O
Isomeric SMILES C1=CC(=CC(=C1)O)C(=O)O
WGK Germany 3
RTECS DH1924980
Molecular Weight 138.12
Beilstein 508160
Reaxy-Rn 508160
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=508160&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.

17 results found

Lot Number Certificate Type Date Item
E2429042 Certificate of Analysis Mar 13, 2024 H104349
D2416302 Certificate of Analysis Mar 13, 2024 H104349
D2416303 Certificate of Analysis Mar 13, 2024 H104349
D2416304 Certificate of Analysis Mar 13, 2024 H104349
D2515008 Certificate of Analysis Nov 29, 2022 H104349
K2327046 Certificate of Analysis Nov 29, 2022 H104349
D2308223 Certificate of Analysis Nov 29, 2022 H104349
D2308219 Certificate of Analysis Nov 29, 2022 H104349
D2308218 Certificate of Analysis Nov 29, 2022 H104349
D2308217 Certificate of Analysis Nov 29, 2022 H104349
D2308216 Certificate of Analysis Nov 29, 2022 H104349
D2515010 Certificate of Analysis Nov 29, 2022 H104349
D2308214 Certificate of Analysis Nov 29, 2022 H104349
H2205236 Certificate of Analysis Jun 12, 2022 H104349
H2205232 Certificate of Analysis Jun 12, 2022 H104349
H2205231 Certificate of Analysis Jun 12, 2022 H104349
H2205230 Certificate of Analysis Jun 12, 2022 H104349

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Chemical and Physical Properties

Solubility Slightly soluble in water;Solubility in Methanol:almost transparency;
Sensitivity Light sensitive.
Flash Point(°F) 428°F
Flash Point(°C) 220℃
Melt Point(°C) 201-207℃
Molecular Weight 138.120 g/mol
XLogP3 1.500
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 138.032 Da
Monoisotopic Mass 138.032 Da
Topological Polar Surface Area 57.500 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 133.000
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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2. Du Wei, Gao Feng, Cui Peng, Yu Zhiwu, Tong Wei, Wang Jihao, Ren Zhuang, Song Chuang, Xu Jiaying, Ma Haifeng, Dang Liyun, Zhang Di, Lu Qingyou, Jiang Jun, Wang Junfeng, Pi Li, Sheng Zhigao, Lu Qingyi.  (2023)  Twisting, untwisting, and retwisting of elastic Co-based nanohelices.  Nature Communications,  14  (1): (1-10). 
3. Xin Lv, Chenying Zhou, Zhichao Shen, Yuchen Zhang, Chuanshu He, Ye Du, Zhaokun Xiong, Rongfu Huang, Peng Zhou, Bo Lai.  (2023)  Waste leather derived porous carbon boosted Fenton oxidation towards removal of diethyl phthalate: Mechanism and long-lasting performance.  JOURNAL OF HAZARDOUS MATERIALS,  458  (132040). 
4. Hui Zhang, Huahui Zeng, Mengfei Li, Yagang Song, Shuo Tian, Jing Xiong, Lan He, Yang Liu, Xiangxiang Wu.  (2022)  Novel Ascorbic Acid Co-Crystal Formulations for Improved Stability.  MOLECULES,  27  (22): (7998). 
5. Yuchen Zhang, Peng Zhou, Rongfu Huang, Chenying Zhou, Yang Liu, Heng Zhang, Xiaowei Huo, Jian Zhao, Zhaokun Xiong, Bo Lai.  (2023)  Iron boride boosted Fenton oxidation: Boron species induced sustainable FeIII/FeII redox couple.  JOURNAL OF HAZARDOUS MATERIALS,  443  (130386). 
6. Xin Wang, Jinshuang Hu, Boxuan Yao, Hua Wei, Caiyun Zhang, Jiarui Zhou, Jian Liu, Shenghong Yang.  (2023)  Bridging environmental and biological monitoring: Constructing platform for hexavalent chromium detection and cancer-cells screening based on red fluorescent carbonized polymer dots.  CHEMICAL ENGINEERING JOURNAL,  451  (138524). 
7. Yiming Sun, Peng Zhou, Peng Zhang, Shuang Meng, Chenying Zhou, Yang Liu, Heng Zhang, Zhaokun Xiong, Xiaoguang Duan, Bo Lai.  (2022)  New insight into carbon materials enhanced Fenton oxidation: A strategy for green iron(III)/iron(II) cycles.  CHEMICAL ENGINEERING JOURNAL,  450  (138423). 
8. Xianhu Long, Zhaokun Xiong, Rongfu Huang, Yahan Yu, Peng Zhou, Heng Zhang, Gang Yao, Bo Lai.  (2022)  Sustainable Fe(III)/Fe(II) cycles triggered by co-catalyst of weak electrical current in Fe(III)/peroxymonosulfate system: Collaboration of radical and non-radical mechanisms.  APPLIED CATALYSIS B-ENVIRONMENTAL,  317  (121716). 
9. Shan Tu, Zhigang Wang, Wentao Zhang, Yuanpeng Li, Yulai She, Hao Du, Cancan Yi, Bo Qin, Zhiqiang Liu.  (2022)  A new technology for rapid determination of isomers of hydroxybenzoic acid by terahertz spectroscopy.  SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY,  279  (121313). 
10. Shan Tu, Zhigang Wang, Wentao Zhang, Huapeng Xiao, Yulai She, Yuan Tang, Cancan Yi, Guoling Liang.  (2021)  Study of weak intermolecular interactions and vibrational modes in hydroxybenzoic acid isomers using terahertz spectroscopy and density functional theory techniques.  INFRARED PHYSICS & TECHNOLOGY,  119  (103950). 
11. Yunan Zhang, Yu Duan, Jin Su, Lixin Liu, Yanru Feng, Lili Wu, Lei Zhang, Yunjie Zhang, Dongyu Zou, Yingli Liu.  (2021)  Inspiration for revival of old drugs: improving solubility and avoiding hygroscopicity of pipemidic acid by forming two pharmaceutical salts based on charge-assisted hydrogen bond recognitions.  NEW JOURNAL OF CHEMISTRY,  45  (42): (19704-19713). 
12. Haipeng Jiang, Xin Qu, Li He, Zheng Lv, Dan Li, Fengyou Wang, Lin Fan, Jinghai Yang, Lili Yang, Yongsheng Yan.  (2022)  A design strategy of additive molecule for PSCs: Anchoring intrinsic properties of functional groups by suppressing long-range conjugation effect.  CHEMICAL ENGINEERING JOURNAL,  427  (131676). 
13. Qi Zhou, Xuelin Dong, Binbin Zhang, Shan Lu, Xinwei Zhang, Qin Wang, Yonggui Liao, Yajiang Yang, Hong Wang.  (2021)  Luminescence sensitization of terbium-loaded supramolecular gels by hydroxybenzoic acids and used for salicylates sensing.  TALANTA,  225  (122061). 
14. Shiyun Tang, Yuanxing Duan, Feng Chang, Wei Jiang, Fengmei Zhang, Zhihua Liu, Yuting Yang, Chunbo Liu, Yingzhuang Chen.  (2020)  The fabrication of carboxylic acid-functionalized porous layer open tube column and its application in hydrophilic interaction chromatography for small polar molecules.  JOURNAL OF LIQUID CHROMATOGRAPHY & RELATED TECHNOLOGIES,     
15. Jinyue Yang, Na Wang, Beiqian Tian, Xiongtao Ji, Baohong Hou, Ting Wang, Xin Huang, Junquan Su, Zhanao Yang, Hongxun Hao.  (2020)  Multicomponent supramolecular assembly of p-hydroxybenzoic acid and malonic acid: a deep insight into the formation of selective cocrystals.  CRYSTENGCOMM,  22  (34): (5628-5637). 
16. Xu Yu, Li Yu, Fei Ma, Peiwu Li.  (2021)  Quantification of phenolic compounds in vegetable oils by mixed-mode solid-phase extraction isotope chemical labeling coupled with UHPLC-MS/MS.  FOOD CHEMISTRY,  334  (127572). 
17. Ao Qian, Songhu Yuan, Shiwei Xie, Man Tong, Peng Zhang, Yunsong Zheng.  (2019)  Oxidizing Capacity of Iron Electrocoagulation Systems for Refractory Organic Contaminant Transformation.  ENVIRONMENTAL SCIENCE & TECHNOLOGY,  53  (21): (12629–12638). 
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19. Chen Xin, Tang Hongzhi, Liu Yongdi, Xu Ping, Xue Yong, Lin Kuangfei, Cui Changzheng.  (2018)  Purification and Initial Characterization of 3-Hydroxybenzoate 6-Hydroxylase From a Halophilic Martelella Strain AD-3.  Frontiers in Microbiology,  (1335). 
20. Lala Rukh Sidra, Guofei Chen, Cuiyun Li, Nafeesa Mushtaq, Kai Ma, Xingzhong Fang.  (2018)  Processable, high Tg polyimides from unsymmetrical diamines containing 4-phenoxy aniline and benzimidazole moieties.  POLYMER,  148  (228). 
21. Lala Rukh Sidra, Guofei Chen, Nafeesa Mushtaq, Kai Ma, Beenish Bashir, Xingzhong Fang.  (2018)  Processable poly(benzoxazole imide)s derived from asymmetric benzoxazole diamines containing 4-phenoxy aniline: synthesis, properties and the isomeric effect.  Polymer Chemistry,  (20): (2785-2796). 
22. Dan Liu, Ting Qiao, Haiyan Liu, Xiaoling Wang, Zhi-guo Shi.  (2017)  A simple approach to prepare a sulfone-embedded stationary phase for HPLC.  JOURNAL OF SEPARATION SCIENCE,  41  (4): (877-885). 
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