2-(4-Methylbenzoyl)benzoic acid

C₁₅H₁₂O₃CAS 85-55-2240.26 g/mol

Open in Covalent MOL file

Alcohol Carboxylic Acid Ketone

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 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 3

Identifiers

CAS number

85-55-2

SMILES

Cc1ccc(C(=O)c2ccccc2C(=O)O)cc1

InChIKey

ICQOWIXIHDDXDI-UHFFFAOYSA-N

InChI

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

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

1-(2-Hydroxyphenyl)-3-phenyl-1,3-propanedione1469-94-9 2′-Hydroxyflavanone17348-76-4 3-Benzoylbenzeneacetic acid22071-22-3 1-[2-(Benzoyloxy)phenyl]ethanone4010-33-7 (±)-6-Hydroxyflavanone4250-77-5 Methyl O-benzoylbenzoate606-28-0 7-Hydroxyflavanone6515-36-2 4′-Hydroxyflavanone6515-37-3

Elsewhere

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