4-Methylbenzenebutanoic acid
Properties
- Molecular formula
- C11H14O2
- Molar mass
- 178.23 g/mol
- Exact mass
- 178.0994 Da
- Melting point
- 144 °C
- Boiling point
- 155 °C (at 3 Torr)
- logP
- 2.40Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 4
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
4521-22-6SMILES
Cc1ccc(CCCC(=O)O)cc1InChIKey
IXWOVMRDYFFXGI-UHFFFAOYSA-NInChI
InChI=1S/C11H14O2/c1-9-5-7-10(8-6-9)3-2-4-11(12)13/h5-8H,2-4H2,1H3,(H,12,13)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- Benzenebutanoic acid, 4-methyl-
- Butyric acid, 4-p-tolyl-
- 4-p-Tolylbutyric acid
- 4-(4-Methylphenyl)butyric acid
- NSC 57013
- 4-(4-Methylphenyl)butanoic acid
- 4-(p-Tolyl)butanoic acid
Work with 4-Methylbenzenebutanoic acid
Similar compounds
3-(4-Methylphenyl)propionic acid1505-50-679 % similar
4-Phenylbutyric acid1821-12-167 % similar
4-Hydroxybenzenebutanoic acid7021-11-666 % similar
p-Tolylacetic acid622-47-965 % similar
4-(4-Aminophenyl)butanoic acid15118-60-264 % similar
4-(4-Bromophenyl)butanoic acid35656-89-464 % similar
4-(4-Fluorophenyl)butanoic acid589-06-064 % similar
4-Methoxybenzenebutanoic acid4521-28-263 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds