Methyl 3-methoxy-4-methylbenzoate
Properties
- Molecular formula
- C10H12O3
- Molar mass
- 180.20 g/mol
- Exact mass
- 180.0786 Da
- Melting point
- 46–48 °C
- Boiling point
- 138–142 °C (at 20 Torr)
- logP
- 1.79Crippen estimate
- Polar surface area
- 35.5 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 2
Hazards
Warning
- H315 Causes skin irritation97.6% of notifiers
- H319 Causes serious eye irritation97.6% of notifiers
- H335 May cause respiratory irritation97.6% of notifiers
Aggregated from 41 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
3556-83-0SMILES
COC(=O)c1ccc(C)c(OC)c1InChIKey
LLEXCSBUSVRBCA-UHFFFAOYSA-NInChI
InChI=1S/C10H12O3/c1-7-4-5-8(10(11)13-3)6-9(7)12-2/h4-6H,1-3H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Benzoic acid, 3-methoxy-4-methyl-, methyl ester
- m-Anisic acid, 4-methyl-, methyl ester
- 3-Methoxy-4-methylbenzoic acid methyl ester
- Methyl 4-methyl-3-(methyloxy)benzoate
Work with Methyl 3-methoxy-4-methylbenzoate
Similar compounds
Methyl 3,4-dimethoxybenzoate2150-38-173 % similar
Methyl 3,4-dimethylbenzoate38404-42-170 % similar
Methyl 3-amino-4-methylbenzoate18595-18-167 % similar
Methyl 4-amino-3-methoxybenzoate41608-64-467 % similar
Methyl 3-iodo-4-methoxybenzoate35387-93-065 % similar
Methyl vanillate3943-74-665 % similar
Methyl 3-iodo-4-methylbenzoate90347-66-364 % similar
Methyl 3-bromo-4-methylbenzoate104901-43-162 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.