chempirical

3-Methoxydiphenylamine

C13H13NOCAS 101-16-6199.25 g/mol

Open in Covalent MOL file
ONH
EtherSecondary amine

Properties

Molecular formula
C13H13NO
Molar mass
199.25 g/mol
Exact mass
199.0997 Da
Melting point
73 °C
Boiling point
136–138 °C (at 0.07 Torr)
logP
3.44Crippen estimate
Polar surface area
21.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
3

Identifiers

CAS number
101-16-6
SMILES
COc1cccc(Nc2ccccc2)c1
InChIKey
MKASXAGBWHIGCF-UHFFFAOYSA-N
InChI
InChI=1S/C13H13NO/c1-15-13-9-5-8-12(10-13)14-11-6-3-2-4-7-11/h2-10,14H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

8 names
  • N-(m-Methoxyphenyl)aniline
  • Benzenamine, 3-methoxy-N-phenyl-
  • m-Anisidine, N-phenyl-
  • 3-Methoxy-N-phenylbenzenamine
  • N-Phenyl-m-anisidine
  • m-Methoxydiphenylamine
  • N-(3-Methoxyphenyl)-N-phenylamine
  • 3-Methoxy-N-phenylaniline

Work with 3-Methoxydiphenylamine

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

1,3-Dimethoxybenzene151-10-058 % similar (3-Methoxyphenyl)hydrazine hydrochloride39232-91-258 % similar 4-Methoxy-2-methyl-N-phenylbenzenamine41317-15-157 % similar Anisole100-66-354 % similar Bis(4-methoxyphenyl)amine101-70-254 % similar 3-Methylanisole100-84-553 % similar 3-Methyldiphenylamine1205-64-753 % similar N-(Cinnamoyl)-3-methoxyaniline127033-74-350 % similar

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

Same formula

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 1,2,3,9-Tetrahydro-9-methyl-4H-carbazol-4-one27387-31-1

Elsewhere

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