chempirical

1-Phenyl-4-phosphorinanone

C11H13OPCAS 23855-87-0192.20 g/mol

Open in Covalent MOL file
PO
KetonePhosphine

Properties

Molecular formula
C11H13OP
Molar mass
192.20 g/mol
Exact mass
192.0704 Da
logP
2.16Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
23855-87-0
SMILES
C1CP(CCC1=O)C2=CC=CC=C2
InChIKey
BECOPHRLDVQPNZ-UHFFFAOYSA-N
InChI
InChI=1S/C11H13OP/c12-10-6-8-13(9-7-10)11-4-2-1-3-5-11/h1-5H,6-9H2

Weigh it out

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

Names and synonyms

5 names
  • 1-Phenylphosphinan-4-one
  • 4-Phosphorinanone,1-phenyl-
  • 1-Phenyl-phosphinan-4-one
  • 1-Phenyl-4-phosphinanone
  • 1-Phenylphosphorinan-4-one

Work with 1-Phenyl-4-phosphorinanone

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

Bis(diphenylphosphinoethyl)phenylphosphine23582-02-750 % similar 1-Benzyl-4-piperidone3612-20-245 % similar 4-Phenylcyclohexanone4894-75-144 % similar Dibenzyl ketone102-04-541 % similar Diethylphenylphosphine1605-53-441 % similar 1-Phenyl-3-hexanone29898-25-741 % similar N-Phenethyl-4-piperidinone39742-60-441 % similar 1,2-Bis(diphenylphosphino)ethane1663-45-241 % similar

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

Same formula

3-Methyl-1-phenyl-2-phospholene 1-oxide707-61-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook