Introduction:Basic information about CAS 3934-84-7|3,4-Dihydroxy-5-methoxybenzoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3,4-Dihydroxy-5-methoxybenzoic acid |
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| CAS Number | 3934-84-7 | Molecular Weight | 184.146 |
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| Density | 1.5±0.1 g/cm3 | Boiling Point | 433.7±45.0 °C at 760 mmHg |
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| Molecular Formula | C8H8O5 | Melting Point | 220℃ |
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| MSDS | USA | Flash Point | 183.6±22.2 °C |
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Names
| Name | 3-O-methylgallic acid |
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| Synonym | More Synonyms |
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3,4-Dihydroxy-5-methoxybenzoic acid BiologicalActivity
| Description | 3-O-Methylgallic acid (3,4-Dihydroxy-5-methoxybenzoic acid) is an anthocyanin metabolite and has potent antioxidant capacity. 3-O-methylgallic acid inhibits Caco-2 cell proliferation with an IC50 value of 24.1 μM. 3-O-methylgallic acid also induces cell apoptosis and has anti-cancer effects[1][2]. |
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| Related Catalog | Signaling Pathways >>Apoptosis >>ApoptosisResearch Areas >>Cancer |
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| References | [1]. Forester SC, et al. Gut metabolites of anthocyanins, gallic acid, 3-O-methylgallic acid, and 2,4,6-trihydroxybenzaldehyde, inhibit cell proliferation of Caco-2 cells. J Agric Food Chem. 2010 May 12;58(9):5320-7. [2]. Forester SC, The anthocyanin metabolites gallic acid, 3-O-methylgallic acid, and 2,4,6-trihydroxybenzaldehyde decrease human colon cancer cell viability by regulating pro-oncogenic signals. Mol Carcinog. 2014 Jun;53(6):432-9. |
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Chemical & Physical Properties
| Density | 1.5±0.1 g/cm3 |
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| Boiling Point | 433.7±45.0 °C at 760 mmHg |
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| Melting Point | 220℃ |
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| Molecular Formula | C8H8O5 |
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| Molecular Weight | 184.146 |
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| Flash Point | 183.6±22.2 °C |
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| Exact Mass | 184.037170 |
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| PSA | 86.99000 |
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| LogP | 1.19 |
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| Vapour Pressure | 0.0±1.1 mmHg at 25°C |
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| Index of Refraction | 1.629 |
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| InChIKey | KWCCUYSXAYTNKA-UHFFFAOYSA-N |
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| SMILES | COc1cc(C(=O)O)cc(O)c1O |
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Safety Information
| Hazard Codes | Xi |
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| Risk Phrases | 36/37/38 |
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| Safety Phrases | 26-36/37/39 |
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| HS Code | 2918990090 |
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Customs
| HS Code | 2918990090 |
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| Summary | 2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
| 3,4-Dihydroxy-5-methoxybenzoic acid |
| MFCD00016518 |
| EINECS 223-512-8 |
| Benzoic acid, 3,4-dihydroxy-5-methoxy- |