chempirical

(2-Aminophenyl)dimethylphosphine oxide

C8H12NOPCAS 1197953-47-1169.16 g/mol

Open in Covalent MOL file
POH2N
Primary amine

Properties

Molecular formula
C8H12NOP
Molar mass
169.16 g/mol
Exact mass
169.0657 Da
logP
1.52Crippen estimate
Polar surface area
43.1 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
1197953-47-1
SMILES
CP(=O)(C)C1=CC=CC=C1N
InChIKey
DHHGHQKIKXKQGJ-UHFFFAOYSA-N
InChI
InChI=1S/C8H12NOP/c1-11(2,10)8-6-4-3-5-7(8)9/h3-6H,9H2,1-2H3

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Names and synonyms

1 names
  • 2-(Dimethylphosphoryl)aniline

Work with (2-Aminophenyl)dimethylphosphine oxide

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

2-tert-Butylaniline6310-21-039 % similar 2-Isopropylaniline643-28-739 % similar O-Toluidine95-53-438 % similar 2,6-Diaminotoluene823-40-536 % similar O-Anisidine90-04-035 % similar (2-((2,5-Dichloropyrimidin-4-yl)amino)phenyl)dimethylphosphine oxide1197953-49-335 % similar 2-Bromoaniline615-36-134 % similar 2,3-Diaminotoluene2687-25-434 % similar

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

Elsewhere

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