3-[(4-Methylphenyl)amino]phenol

C₁₃H₁₃NOCAS 61537-49-3199.25 g/mol

Open in Covalent MOL file

Phenol Secondary amine

Properties

Molecular formula: C₁₃H₁₃NO
Molar mass: 199.25 g/mol
Exact mass: 199.0997 Da
Melting point: 82 °C
logP: 3.44Crippen estimate
Polar surface area: 32.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2

Identifiers

CAS number

61537-49-3

SMILES

Cc1ccc(Nc2cccc(O)c2)cc1

InChIKey

TWYLNUMRYUFZIN-UHFFFAOYSA-N

InChI

InChI=1S/C13H13NO/c1-10-5-7-11(8-6-10)14-12-3-2-4-13(15)9-12/h2-9,14-15H,1H3

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Names and synonyms

3 names

Phenol, 3-[(4-methylphenyl)amino]-
5-[(4-Methylphenyl)amino]phenol
3-p-Tolylamino-phenol

Work with 3-[(4-Methylphenyl)amino]phenol

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

3-Hydroxydiphenylamine101-18-869 % similar M-Cresol108-39-459 % similar 4-Methyldiphenylamine620-84-859 % similar Bis(4-methylphenyl)amine620-93-956 % similar 3-[(2-Methylphenyl)amino]phenol6264-98-856 % similar 3-Methyldiphenylamine1205-64-755 % similar N,N'-Di-(4-methyl-phenyl)-benzidine10311-61-250 % similar 4-Hydroxydiphenylamine122-37-248 % similar

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

Same formula

3-Methoxydiphenylamine101-16-6 4-(Benzylamino)phenol103-14-0 4-Phenoxybenzenemethanamine107622-80-0 N-(4-Methoxyphenyl)aniline1208-86-2 2-Aminobenzhydrol13209-38-6 3-(Benzyloxy)aniline1484-26-0 2-Benzyloxyaniline20012-63-9 4-Oxo-1-phenylcyclohexanecarbonitrile25115-74-6

Elsewhere

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