2,5-Dimethylbenzeneacetic acid
Properties
- Molecular formula
- C10H12O2
- Molar mass
- 164.20 g/mol
- Exact mass
- 164.0837 Da
- Melting point
- 128 °C
- logP
- 1.93Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 2
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation85.7% of notifiers
Aggregated from 7 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
13612-34-5SMILES
Cc1ccc(C)c(CC(=O)O)c1InChIKey
RUSCTNYOPQOXDJ-UHFFFAOYSA-NInChI
InChI=1S/C10H12O2/c1-7-3-4-8(2)9(5-7)6-10(11)12/h3-5H,6H2,1-2H3,(H,11,12)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- Benzeneacetic acid, 2,5-dimethyl-
- Acetic acid, (2,5-xylyl)-
- 2,5-Dimethylphenylacetic acid
- 2,5-Xylylacetic acid
- 2-(2,5-Dimethylphenyl)acetic acid
Work with 2,5-Dimethylbenzeneacetic acid
Similar compounds
2-(2-Fluoro-5-methylphenyl)acetic acid203314-27-667 % similar
2-Fluoro-4-methylbenzeneacetic acid518070-28-562 % similar
(2-Methylphenyl)acetic acid644-36-062 % similar
2,4,6-Trimethylbenzeneacetic acid4408-60-057 % similar
2,5-Xylyloxyacetic acid7356-41-456 % similar
5-Methyl-3-indoleacetic acid1912-47-656 % similar
p-Tolylacetic acid622-47-956 % similar
(3-Methylphenyl)acetic acid621-36-354 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.