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| | (3,4-Dimethoxyphenyl)acetic acid Basic information |
| Product Name: | (3,4-Dimethoxyphenyl)acetic acid | | Synonyms: | 3,4-Dimethoxyphenylacetic acid,3,4-Dimethoxyphenylacetic acid, Homoveratric acid;4-DiMethoxyphenylacetic acid;2-(3,4-DiMethoxyphenyl)acetate;(3,4-DiMethoxyphenyl)acetic acid, 99% 100GR;(3,4-DiMethoxyphenyl)acetic acid, 99% 25GR;(3,4-DiMethoxyphenyl)acetic acid, 99% 500GR;NSC 2753;NSC 27897 | | CAS: | 93-40-3 | | MF: | C10H12O4 | | MW: | 196.2 | | EINECS: | 202-244-5 | | Product Categories: | Catechol Derivatives;Aromatic Phenylacetic Acids and Derivatives;Aromatics, Metabolites & Impurities, Neurochemicals, Pharmaceuticals, Intermediates & Fine Chemicals;Inhibitors | | Mol File: | 93-40-3.mol |  |
| | (3,4-Dimethoxyphenyl)acetic acid Chemical Properties |
| Melting point | 96-98 °C (lit.) | | Boiling point | 293.08°C (rough estimate) | | density | 1.2166 (rough estimate) | | refractive index | 1.5430 (estimate) | | storage temp. | Sealed in dry,Room Temperature | | solubility | Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) | | pka | pK1:4.333 (25°C) | | form | Powder | | color | White to beige | | Water Solubility | SOLUBLE | | BRN | 1110282 | | InChI | 1S/C10H12O4/c1-13-8-4-3-7(6-10(11)12)5-9(8)14-2/h3-5H,6H2,1-2H3,(H,11,12) | | InChIKey | WUAXWQRULBZETB-UHFFFAOYSA-N | | SMILES | COc1ccc(CC(O)=O)cc1OC | | LogP | 1.242 | | CAS DataBase Reference | 93-40-3(CAS DataBase Reference) | | NIST Chemistry Reference | Acetic acid, 3,4-dimethoxyphenyl-(93-40-3) | | EPA Substance Registry System | Benzeneacetic acid, 3,4-dimethoxy- (93-40-3) |
| | (3,4-Dimethoxyphenyl)acetic acid Usage And Synthesis |
| Chemical Properties | white to beige powder | | Uses | Homoveratric Acid is a dopamine metabolite that inhibits brain mitochondrial respiration via monoamine oxidase/H2O2-dependent or non-dependent pathway. | | Uses | It reacts with formaldehyde in the presence of acid to give an isochromanone. | | Definition | ChEBI: Homoveratric acid is a phenylacetic acid substituted at positions 3 and 4 by methoxy groups. It has a role as a human urinary metabolite and a human xenobiotic metabolite. It is a dimethoxybenzene and a member of phenylacetic acids. | | Synthesis Reference(s) | Organic Syntheses, Coll. Vol. 2, p. 333, 1943
The Journal of Organic Chemistry, 15, p. 548, 1950 DOI: 10.1021/jo01149a016 | | Purification Methods | Crystallise homoveratric acid from H2O or *C6H6/ligroin. The amide has m 142o (from H2O). [Beilstein 10 H 409, 10 I 197, 10 II 268, 10 III 1459, 10 IV 1509.] |
| | (3,4-Dimethoxyphenyl)acetic acid Preparation Products And Raw materials |
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