3-(P-Tolyl)propionic acid
Properties
- Molecular formula
- C10H12O2
- Molar mass
- 164.20 g/mol
- Exact mass
- 164.0837 Da
- Melting point
- 117–118 °C
- logP
- 2.01Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 3
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
1505-50-6SMILES
Cc1ccc(CCC(=O)O)cc1InChIKey
LDYGRLNSOKABMM-UHFFFAOYSA-NInChI
InChI=1S/C10H12O2/c1-8-2-4-9(5-3-8)6-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
11 names
- 3-(4-Methylphenyl)propionic acid
- Benzenepropanoic acid, 4-methyl-
- Hydrocinnamic acid, p-methyl-
- 4-Methylbenzenepropanoic acid
- 4-Methyl-β-phenylpropionic acid
- p-Methylhydrocinnamic acid
- 3-(4-Methylphenyl)propanoic acid
- 3-p-Tolylpropionic acid
- 4-Methylbenzenepropionic acid
- NSC 512
- 3-p-Tolylpropanoic acid
Work with 3-(P-Tolyl)propionic acid
Similar compounds
4-Methylbenzenebutanoic acid4521-22-679 % similar
1,4-Benzenedipropanoic acid4251-21-276 % similar
p-Tolylacetic acid622-47-969 % similar
3-(3-Methylphenyl)propionic acid3751-48-267 % similar
Phloretic acid501-97-363 % similar
Phenylpropanoic acid501-52-062 % similar
3-(4-Iodophenyl)propionic acid1643-29-461 % similar
3-(4-Bromophenyl)propionic acid1643-30-761 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds