CAS 3934-84-7|3,4-Dihydroxy-5-methoxybenzoic acid

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 Name3,4-Dihydroxy-5-methoxybenzoic acid
CAS Number3934-84-7Molecular Weight184.146
Density1.5±0.1 g/cm3Boiling Point433.7±45.0 °C at 760 mmHg
Molecular FormulaC8H8O5Melting Point220℃
MSDSUSAFlash Point183.6±22.2 °C

Names

Name3-O-methylgallic acid
SynonymMore Synonyms

3,4-Dihydroxy-5-methoxybenzoic acid BiologicalActivity

Description3-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].
Related CatalogSignaling Pathways >>Apoptosis >>ApoptosisResearch Areas >>Cancer
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.

Chemical & Physical Properties

Density1.5±0.1 g/cm3
Boiling Point433.7±45.0 °C at 760 mmHg
Melting Point220℃
Molecular FormulaC8H8O5
Molecular Weight184.146
Flash Point183.6±22.2 °C
Exact Mass184.037170
PSA86.99000
LogP1.19
Vapour Pressure0.0±1.1 mmHg at 25°C
Index of Refraction1.629
InChIKeyKWCCUYSXAYTNKA-UHFFFAOYSA-N
SMILESCOc1cc(C(=O)O)cc(O)c1O

Safety Information

Hazard CodesXi
Risk Phrases36/37/38
Safety Phrases26-36/37/39
HS Code2918990090

Customs

HS Code2918990090
Summary2918990090. 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%

Synonyms

3,4-Dihydroxy-5-methoxybenzoic acid
MFCD00016518
EINECS 223-512-8
Benzoic acid, 3,4-dihydroxy-5-methoxy-
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