3,5-Dimethoxybenzoic acid
Properties
- Molecular formula
- C9H10O4
- Molar mass
- 182.17 g/mol
- Exact mass
- 182.0579 Da
- Melting point
- 185.5 °C
- logP
- 1.40Crippen estimate
- Polar surface area
- 55.8 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 3
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.9% of notifiers
Aggregated from 48 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
1132-21-4SMILES
COc1cc(OC)cc(C(=O)O)c1InChIKey
IWPZKOJSYQZABD-UHFFFAOYSA-NInChI
InChI=1S/C9H10O4/c1-12-7-3-6(9(10)11)4-8(5-7)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
3 names
- Benzoic acid, 3,5-dimethoxy-
- NSC 43744
- NSC 8514
Work with 3,5-Dimethoxybenzoic acid
Similar compounds
5-Methoxyisophthalic acid46331-50-492 % similar
3-Bromo-5-methoxybenzoic acid157893-14-677 % similar
3-Chloro-5-methoxybenzoic acid82477-67-674 % similar
3-Methoxybenzoic acid586-38-968 % similar
3-Methoxy-5-(trifluoromethyl)benzoic acid53985-48-168 % similar
p-Anisic acid100-09-466 % similar
3-Methoxy-5-nitrobenzoic acid78238-12-764 % similar
Eudesmic acid118-41-261 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.