Veratric acid
Properties
- Molecular formula
- C9H10O4
- Molar mass
- 182.17 g/mol
- Exact mass
- 182.0579 Da
- Melting point
- 181 °C
- logP
- 1.40Crippen estimate
- Polar surface area
- 55.8 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 3
Hazards
Warning
- H302 Harmful if swallowed14.3% of notifiers
- H315 Causes skin irritation80% of notifiers
- H319 Causes serious eye irritation80% of notifiers
- H335 May cause respiratory irritation78.6% of notifiers
Aggregated from 70 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
93-07-2SMILES
COc1ccc(C(=O)O)cc1OCInChIKey
DAUAQNGYDSHRET-UHFFFAOYSA-NInChI
InChI=1S/C9H10O4/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- Benzoic acid, 3,4-dimethoxy-
- 3,4-Dimethoxybenzoic acid
- Dimethylprotocatechuic acid
- NSC 7721
- 3,4-Bis(methyloxy)benzoic acid
Work with Veratric acid
Similar compounds
3′,4′-Dimethoxy[1,1′-biphenyl]-4-carboxylic acid122294-10-476 % similar
4-Methoxy-1,3-benzenedicarboxylic acid2206-43-175 % similar
3-Ethoxy-4-methoxybenzoic acid2651-55-074 % similar
Vanillic acid121-34-673 % similar
4-Amino-3-methoxybenzoic acid2486-69-373 % similar
3-Amino-4-methoxybenzoic acid2840-26-873 % similar
Isovanillic acid645-08-973 % similar
4-Methoxy-3-methylbenzoic acid6880-04-273 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.