Basic information
- CAS
24765-61-5- Standard SMILES
CC1C(C)(C)P(=O)(c2ccccc2)C1(C)C- InChIKey
XUNRSVNAHRPKRH-UHFFFAOYSA-N- Molecular formula
- C14H21OP
- Average molar mass
- 236.29 g/mol
- Monoisotopic mass
- 236.13300229
Names & identifiers
- Preferred name
- 2,2,3,4,4-Pentamethyl-1-phenyl-phosphetane 1-oxide
- IUPAC
- 2,2,3,4,4-pentamethyl-1-phenyl-1λ5-phosphetane 1-oxide
Names & synonyms
NSC61700324765-61-5SCHEMBL11426415DTXSID60310915NSC234216NSC-234216NSC-6170032,2,3,4,4-Pentamethyl-1-phenyl-phosphetane 1-oxidePhosphetane,2,3,4,4-pentamethyl-1-phenyl-, 1-oxide2,2,3,4,4-Pentamethyl-1-phenyl-1lambda~5~-phosphetan-1-one
Database identifiers
- CAS
24765-61-5- PubChem CID
- 314729
- DTXSID
DTXSID60310915
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 304
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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