2,5-Dimethylbenzoic acid
Properties
- Molecular formula
- C9H10O2
- Molar mass
- 150.18 g/mol
- Exact mass
- 150.0681 Da
- Melting point
- 132 °C
- logP
- 2.00Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
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 46 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
610-72-0SMILES
Cc1ccc(C)c(C(=O)O)c1InChIKey
XZRHNAFEYMSXRG-UHFFFAOYSA-NInChI
InChI=1S/C9H10O2/c1-6-3-4-7(2)8(5-6)9(10)11/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, 2,5-dimethyl-
- Isoxylic acid
- 2-Carboxy-1,4-dimethylbenzene
Work with 2,5-Dimethylbenzoic acid
Similar compounds
2,4-Dimethylbenzoic acid611-01-873 % similar
4-Methylphthalic acid4316-23-872 % similar
2-Iodo-5-methylbenzoic acid52548-14-869 % similar
5-Iodo-2-methylbenzoic acid54811-38-066 % similar
5-Hydroxy-2-methylbenzoic acid578-22-366 % similar
5-Methylsalicylic acid89-56-566 % similar
2,5-Dimethylterephthalic acid6051-66-764 % similar
5-Amino-2-methylbenzoic acid2840-04-264 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.