4-(1-Methylethyl)benzeneacetic acid
Properties
- Molecular formula
- C11H14O2
- Molar mass
- 178.23 g/mol
- Exact mass
- 178.0994 Da
- Melting point
- 38–40 °C
- Boiling point
- 170–174 °C (at 14 Torr)
- logP
- 2.44Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 3
Hazards
Warning
- H302 Harmful if swallowed88.9% of notifiers
- H315 Causes skin irritation13.3% of notifiers
- H319 Causes serious eye irritation13.3% of notifiers
- H335 May cause respiratory irritation13.3% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
4476-28-2SMILES
CC(C)c1ccc(CC(=O)O)cc1InChIKey
RERBQXVRXYCGLT-UHFFFAOYSA-NInChI
InChI=1S/C11H14O2/c1-8(2)10-5-3-9(4-6-10)7-11(12)13/h3-6,8H,7H2,1-2H3,(H,12,13)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
8 names
- Benzeneacetic acid, 4-(1-methylethyl)-
- p-Cymene-7-carboxylic acid
- p-Isopropylphenylacetic acid
- 2-(4-Isopropylphenyl)acetic acid
- 4-(Propan-2-yl)phenylacetic acid
- 2-(4-Propan-2-ylphenyl)acetic acid
- 2-[4-(Propan-2-yl)phenyl]acetic acid
- 4-Isopropylphenylacetic acid
Work with 4-(1-Methylethyl)benzeneacetic acid
Similar compounds
1,4-Benzenediacetic acid7325-46-467 % similar
4-Isopropylphenoxyacetic acid1643-16-963 % similar
p-Tolylacetic acid622-47-959 % similar
4-Hydroxyphenylacetic acid156-38-756 % similar
4-(Hydroxymethyl)phenylacetic acid73401-74-856 % similar
Phenylacetic acid103-82-255 % similar
4-Aminophenylacetic acid1197-55-355 % similar
4-(Bromomethyl)phenylacetic acid13737-36-555 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.