chempirical

Bis(4-methylphenyl)phosphine oxide

C14H15OPCAS 2409-61-2230.25 g/mol

Open in Covalent MOL file
PHO

Properties

Molecular formula
C14H15OP
Molar mass
230.25 g/mol
Exact mass
230.0861 Da
Melting point
119–121 °C
logP
2.81Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Identifiers

CAS number
2409-61-2
SMILES
Cc1ccc([PH](=O)c2ccc(C)cc2)cc1
InChIKey
GCUWBTGMXUIKOB-UHFFFAOYSA-N
InChI
InChI=1S/C14H15OP/c1-11-3-7-13(8-4-11)16(15)14-9-5-12(2)6-10-14/h3-10,16H,1-2H3

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Names and synonyms

8 names
  • Phosphine oxide, bis(4-methylphenyl)-
  • Phosphine oxide, di-p-tolyl-
  • Bis-p-tolylphosphine oxide
  • Di-p-tolylphosphine oxide
  • Di(4-methylphenyl)phosphinous acid
  • Bis(4-tolyl)phosphine oxide
  • Di(para-tolyl)phosphine oxide
  • 1-Methyl-4-[(4-methylphenyl)-oxidophosphaniumyl]benzene

Work with Bis(4-methylphenyl)phosphine 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

P-Xylene106-42-350 % similar 4-Methylbenzaldehyde104-87-044 % similar 1,1′-Oxybis[4-methylbenzene]1579-40-443 % similar P-Tolyl disulfide103-19-539 % similar 1,2-Bis(4-methylphenyl)ethane538-39-639 % similar 1,1′-Sulfinylbis[4-methylbenzene]1774-35-238 % similar 1,2-Bis(4-methylphenyl)-1,2-ethanedione3457-48-538 % similar 4,4′-Dimethylbenzophenone611-97-238 % similar

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

Same formula

Ethyldiphenylphosphine oxide1733-57-9 Ethyl P,P-diphenylphosphinite719-80-2

Elsewhere

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