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Basic Description
| Synonyms | 3,4-Dimethoxybenzaldehyde | VERATRALDEHYDE | 120-14-9 | Veratric aldehyde | Methylvanillin | Benzaldehyde, 3,4-dimethoxy- | Vanillin methyl ether | Veratral | Veratrum aldehyde | Veratryl aldehyde | p-Veratric aldehyde | 4-O-Methylvanillin | 3,4-Dimethoxy benzaldehyde | 3,4-Dimeth |
|---|---|
| Specifications & Purity | 10mM in DMSO |
| Storage Temp | Store at -80°C |
| Shipped In |
Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available. |
| Product Description |
3,4-dimethoxybenzaldehyde and cyclodextrin form a 1:1 inclusion compound. It reacts with 3-acetyl-2,5-dimethylthiophene to form chalcone dye 2e-3 - (3,4-dimethoxyphenyl) - 1 - (2,5-dimethylthiophene-3-yl) propyl-2-ene-1-one. 3,4-dimethoxybenzaldehyde is used to prepare 4-chloromethyl-2 - (dimethoxyphenyl) - 1,3-dioxygentyl. It is used to synthesize the (+ - violet acid) with anti HIV activity. |
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
- Subclass Methoxybenzenes
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Methoxybenzenes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Dimethoxybenzenes |
| Alternative Parents | Phenoxy compounds Benzoyl derivatives Benzaldehydes Anisoles Alkyl aryl ethers Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Dimethoxybenzene - O-dimethoxybenzene - Anisole - Benzaldehyde - Benzoyl - Phenol ether - Phenoxy compound - Aryl-aldehyde - Alkyl aryl ether - Ether - Organooxygen compound - Aldehyde - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups. |
| External Descriptors | a small molecule |
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Associated Targets(Human)
TSHR
Tclin
Thyroid stimulating hormone receptor (29986 Activities)
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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ALDH1A1
Tchem
Aldehyde dehydrogenase 1A1 (77053 Activities)
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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Associated Targets(non-human)
Meloidogyne incognita (862 Activities)
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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Hepatitis B virus (7925 Activities)
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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Collagen (21 Activities)
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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Mechanisms of Action
| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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Names and Identifiers
| IUPAC Name | 3,4-dimethoxybenzaldehyde |
|---|---|
| INCHI | InChI=1S/C9H10O3/c1-11-8-4-3-7(6-10)5-9(8)12-2/h3-6H,1-2H3 |
| InChIKey | WJUFSDZVCOTFON-UHFFFAOYSA-N |
| Smiles | COC1=C(C=C(C=C1)C=O)OC |
| Isomeric SMILES | COC1=C(C=C(C=C1)C=O)OC |
| WGK Germany | 3 |
| RTECS | YX5088000 |
| Molecular Weight | 166.17 |
| Beilstein | 473899 |
| Reaxy-Rn | 473899 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=473899&ln= |
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
| Sensitivity | air & Light sensitive |
|---|---|
| Flash Point(°F) | 235.4 °F |
| Flash Point(°C) | >110℃ |
| Boil Point(°C) | 281°C |
| Melt Point(°C) | 42-43°C |
| Molecular Weight | 166.170 g/mol |
| XLogP3 | 1.500 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 166.063 Da |
| Monoisotopic Mass | 166.063 Da |
| Topological Polar Surface Area | 35.500 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 147.000 |
| 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
| 1. Xiaoying Ma, Xiufeng Zhang, Buyue Zhang, Dawei Yang, Hongxia Sun, Yalin Tang, Lei Shi. (2024) Dual-responsive fluorescence probe for measuring HSO3− and viscosity and its application in living cells and real foods. FOOD CHEMISTRY, 430 (136930). |
| 2. Yurong Zhuang, Chenchen Wang, Yong Wang, Yuhui Chen, Songqin Liu, Wei Wei. (2023) Colorimetric and surface-enhanced Raman scattering method for vanillin detection based on two types of reduced silver nanoparticles. SENSORS AND ACTUATORS B-CHEMICAL, 393 (134267). |
| 3. Tong Shao, Xiaolei Song, Yufeng Jiang, Chenchen Wang, Peng Li, Shihao Sun, Dingzhong Wang, Wei Wei. (2023) Vanillin-Catalyzed highly sensitive luminol chemiluminescence and its application in food detection. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 294 (122535). |
| 4. Qiu Weihua, Liu Jinru. (2022) Fermenting and Lignin Degradability of a White-Rot Fungus Coriolopsis trogii Using Industrial Lignin as Substrate. APPLIED BIOCHEMISTRY AND BIOTECHNOLOGY, 194 (11): (5220-5235). |
| 5. Haichuan Zhang, Yang Liu, Shiyu Fu, Yulin Deng. (2021) Selective hydrodeoxygenation of lignin model compound (3,4-dimethoxybenzyl alcohol) by Pd/CNX catalyst. INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES, 169 (274). |
| 6. Xue-Qiang Chen, Bingjian Zhang, Zhiguo Zhang. (2021) A novel method of temporary solidification and extraction of underwater fragile relics in their original state. INTERNATIONAL JOURNAL OF ADHESION AND ADHESIVES, 104 (102724). |
| 7. Fei Peng, Bingjie Zheng, Yao Zhang, Aroosha Faheem, Yanyan Chai, Tao Jiang, Xuguang Chen, Yonggang Hu. (2020) Biocatalytic Oxidation of Aromatic Compounds by Spore-Based System. ACS Sustainable Chemistry & Engineering, 8 (37): (14159–14165). |
| 8. Jianrui Zhang, Xiaocui Han, Cheng Yue, Di Liu, Ziyu Lin, Yirong Sun, Liyuan Chen, Jinhui Pang, Zhenhua Jiang. (2020) Synthesis of novel Co(II) complexed bipyrimidine polyimide and preparation of thin film composite membranes. Polymer Chemistry, 11 (31): (5057-5066). |
| 9. Hailong Li, Chao Du, Shujuan Ge, Mengru Liu. (2020) Oxalate formation during ClO2 bleaching of bamboo kraft pulp. NORDIC PULP & PAPER RESEARCH JOURNAL, 35 (1): (18-24). |
| 10. Fanglin Dai, Shenghui Zhou, Xingzhen Qin, Detao Liu, Haisong Qi. (2019) Surfactant-assisted synthesis of mesoporous hafnium- imidazoledicarboxylic acid hybrids for highly efficient hydrogen transfer of biomass-derived carboxides. Molecular Catalysis, 479 (110611). |
| 11. Fanyong Yan, Xiaodong Sun, Ruiqi Zhang, Yingxia Jiang, Jinxia Xu, Junfu Wei. (2019) Enhanced fluorescence probes based on Schiff base for recognizing Cu2+ and effect of different substituents on spectra. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 222 (117222). |
| 12. Zhou Liu, Tiyun Yang, Yuxing Huang, Yang Liu, Liucheng Chen, Libo Deng, Ho Cheung Shum, Tiantian Kong. (2019) Electrocontrolled Liquid Marbles for Rapid Miniaturized Organic Reactions. ADVANCED FUNCTIONAL MATERIALS, 29 (19): (1901101). |
| 13. Hu Li, Zhenyou Gui, Song Yang, Zhiwen Qi, Shunmugavel Saravanamurugan, Anders Riisager. (2018) Catalytic Tandem Reaction for the Production of Jet and Diesel Fuel Range Alkanes. Energy Technology, 6 (6): (1060-1066). |
| 14. Xiufeng Zhang, Xiaoying Ma, Buyue Zhang, Dawei Yang, Ruiyang Bai, Yuexing Gao, Hongxia Sun, Yalin Tang, Lei Shi. (2024) Design and Screening of Fluorescent Probes Based upon Hemicyanine Dyes for Monitoring Mitochondrial Viscosity in Living Cells. JOURNAL OF PHYSICAL CHEMISTRY B, 128 (16): (3910-3918). |
| 15. Zhou Keyun, Liu Xiaowen, Tong Yu, Jiang Wei, Li Yujie, Zhu Tianyu, Xu Defeng, Hu Hang. (2024) Dimethylcurcumin-loaded methoxypolyethylene glycol-dimethylcurcumin conjugate nanoparticles: preparation, characterization and in vitro antitumor study. JOURNAL OF NANOPARTICLE RESEARCH, 26 (10): (1-13). |
| 16. Hai Li, Yang You, Chun Hui Xie, Yun Qi Li, Hai Bo Xie. (2024) High-Performance Adhesive with Wide Working Temperature Range Enabled by the Multivalent Supramolecular Network around Lignin-Derived Noncoplanar Triaryl-imidazolium. MACROMOLECULES, 57 (24): (11361-11372). |
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