2-(4-Methylbenzoyl)benzoic acid
Properties
- Molecular formula
- C15H12O3
- Molar mass
- 240.26 g/mol
- Exact mass
- 240.0786 Da
- Melting point
- 146 °C
- logP
- 2.92Crippen estimate
- Polar surface area
- 54.4 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 3
Hazards
Warning
- H315 Causes skin irritation97.8% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation95.6% of notifiers
Aggregated from 45 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
85-55-2SMILES
Cc1ccc(C(=O)c2ccccc2C(=O)O)cc1InChIKey
ICQOWIXIHDDXDI-UHFFFAOYSA-NInChI
InChI=1S/C15H12O3/c1-10-6-8-11(9-7-10)14(16)12-4-2-3-5-13(12)15(17)18/h2-9H,1H3,(H,17,18)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- Benzoic acid, 2-(4-methylbenzoyl)-
- Benzoic acid, o-(p-toluoyl)-
- 4′-Methylbenzophenone-2-carboxylic acid
- o-(p-Toluoyl)benzoic acid
- 2-(p-Toluoyl)benzoic acid
- 4-Methylbenzophenone-2′-carboxylic acid
- 4′-Methyl-2-benzoylbenzoic acid
- 2-(4′-Methylbenzoyl)benzoic acid
- NSC 11224
Work with 2-(4-Methylbenzoyl)benzoic acid
Similar compounds
2-Benzoylbenzoic acid85-52-972 % similar
2-(4-Hydroxybenzoyl)benzoic acid85-57-469 % similar
2-(4-Fluorobenzoyl)benzoic acid7649-92-567 % similar
2-(4-Chlorobenzoyl)benzoic acid85-56-367 % similar
2-(4-Methoxybenzoyl)benzoic acid1151-15-166 % similar
4′-Methyl[1,1′-biphenyl]-2-carboxylic acid7148-03-059 % similar
p-Toluic acid99-94-559 % similar
4-Methylbenzophenone134-84-958 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.