Phosphine oxide, diphenyloctyl-
Basic information
- CAS
29701-85-7- Standard SMILES
CCCCCCCCP(=O)(c1ccccc1)c1ccccc1- InChIKey
KBUTXTQFETZKEJ-UHFFFAOYSA-N- Molecular formula
- C20H27OP
- Average molar mass
- 314.4 g/mol
- Monoisotopic mass
- 314.17995248
Names & identifiers
- Preferred name
- Phosphine oxide, diphenyloctyl-
- IUPAC
- [octyl(phenyl)phosphoryl]benzene
- English name
- Octyldiphenylphosphine oxide
- Molecular formula
- C20H27OP
- Molecular weight
- 314.4
Names & synonyms
Phosphine oxide, diphenyloctyl-29701-85-7Octyldiphenylphosphine oxideDiphenyl(octyl)phosphine oxideBRN 2861076SCHEMBL1724978DTXSID90183851Octyl(oxo)di(phenyl)-lambda~5~-phosphanePhosphine oxide, octyldiphenyl-
Database identifiers
- CAS
29701-85-7- PubChem CID
- 207340
- DTXSID
DTXSID90183851- Nikkaji
- J1.926.744J
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 9
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 305
Physicochemical properties
- Melting point
- 64 · 64-65 °C
- Boiling point
- 156 · 156-162 °C(Press: 0.2 Torr)
- Density
- 1.0066 g/cm3 · 1.0066 g/cm3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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