2,4,6-Trimethoxybenzoic acid
Properties
- Molecular formula
- C10H12O5
- Molar mass
- 212.20 g/mol
- Exact mass
- 212.0685 Da
- Melting point
- 144–145 °C
- logP
- 1.41Crippen estimate
- Polar surface area
- 65.0 Ų
- H-bond donors / acceptors
- 1 / 4
- Rotatable bonds
- 4
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.8% of notifiers
Aggregated from 45 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
570-02-5SMILES
COc1cc(OC)c(C(=O)O)c(OC)c1InChIKey
JATAKEDDMQNPOQ-UHFFFAOYSA-NInChI
InChI=1S/C10H12O5/c1-13-6-4-7(14-2)9(10(11)12)8(5-6)15-3/h4-5H,1-3H3,(H,11,12)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- Benzoic acid, 2,4,6-trimethoxy-
Work with 2,4,6-Trimethoxybenzoic acid
Similar compounds
2,6-Dimethoxybenzoic acid1466-76-865 % similar
2,6-Difluoro-4-methoxybenzoic acid123843-65-264 % similar
2,4-Dimethoxybenzoic acid91-52-162 % similar
3,5-Dimethoxybenzoic acid1132-21-461 % similar
5-Methoxyisophthalic acid46331-50-461 % similar
2',4',6'-Trimethoxyacetophenone832-58-659 % similar
2,5-Dimethoxybenzoic acid2785-98-057 % similar
Brevifolin90-24-454 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds