Basic information
- CAS
82884-20-6- Standard SMILES
CC1=CC(O)(c2ccccn2)P(=O)(c2ccccc2)C=C1C- InChIKey
PJICAWSJXGVEIJ-UHFFFAOYSA-N- Molecular formula
- C18H18NO2P
- Average molar mass
- 311.3 g/mol
- Monoisotopic mass
- 311.10751581
Names & identifiers
- Preferred name
- 4,5-Dimethyl-1-phenyl-2-(2-pyridinyl)-1,2-dihydro-2-phosphininol 1-oxide
- IUPAC
- 4,5-dimethyl-1-oxo-1-phenyl-2-pyridin-2-yl-1λ5-phosphinin-2-ol
Names & synonyms
82884-20-6NSC364410NSC 3644104,5-Dimethyl-1-phenyl-2-(2-pyridinyl)-1,2-dihydro-2-phosphininol 1-oxideMLS003171213DTXSID201002992NSC-364410SMR0018751194,5-dimethyl-1-oxo-1-phenyl-2-(2-pyridyl)-1$l^{5}-phosphinin-2-ol2-Hydroxy-4,5-dimethyl-1-phenyl-2-(pyridin-2-yl)-1,2-dihydro-1lambda~5~-phosphinin-1-one
Database identifiers
- CAS
82884-20-6- PubChem CID
- 339181
- DTXSID
DTXSID201002992
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 533
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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