chempirical

4'-Methyl-4-biphenylcarboxylic acid

C14H12O2CAS 720-73-0212.25 g/mol

Open in Covalent MOL file
OOH
Carboxylic acid

Properties

Molecular formula
C14H12O2
Molar mass
212.25 g/mol
Exact mass
212.0837 Da
logP
3.36Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

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
720-73-0
SMILES
CC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
InChIKey
RZOCCLOTCXINRG-UHFFFAOYSA-N
InChI
InChI=1S/C14H12O2/c1-10-2-4-11(5-3-10)12-6-8-13(9-7-12)14(15)16/h2-9H,1H3,(H,15,16)

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Names and synonyms

1 names
  • 4'-Methylbiphenyl-4-carboxylic acid

Work with 4'-Methyl-4-biphenylcarboxylic 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

Similar compounds

p-Toluic acid99-94-588 % similar [P-Terphenyl]-4,4''-dicarboxylic acid13653-84-475 % similar [1,1′-Biphenyl]-4,4′-dicarboxylic acid787-70-275 % similar [1,1':3',1'':3'',1'''-Quaterphenyl]-4,4'''-dicarboxylic acid,5',5''-bis(4-carboxyphenyl)-1383925-31-267 % similar 4',4'',4''',4''''-(Ethene-1,1,2,2-tetrayl)tetrabiphenyl-4-carboxylic acid1610858-96-267 % similar 1,3,5-Tris(4-carboxyphenyl)benzene50446-44-167 % similar 4-(4-(3,5-Bis(4-(4-carboxyphenyl)phenyl)phenyl)phenyl)benzoic acid911818-75-267 % similar [1,1′-Biphenyl]-4-carboxylic acid92-92-264 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Diphenylacetic acid117-34-0 4'-Methoxy-[1,1'-biphenyl]-3-carbaldehyde118350-17-7 Benzoin (organic compound)119-53-9 Benzyl benzoate120-51-4 3-(2-Methoxyphenyl)benzaldehyde122801-57-4 3-(3-Methoxyphenyl)benzaldehyde126485-58-3 2-Hydroxy-5-methylbenzophenone1470-57-1 4'-Methylbiphenyl-3-carboxylic acid147404-69-1

Elsewhere

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