Basic information
- CAS
15450-80-3- Standard SMILES
CC1=C(C)CP(C)(=O)C1- InChIKey
PLIBMPRCDNXLHC-UHFFFAOYSA-N- Molecular formula
- C7H13OP
- Average molar mass
- 144.15 g/mol
- Monoisotopic mass
- 144.07040203
Names & identifiers
- Preferred name
- 1,3,4-Trimethyl-2,5-dihydro-1H-1lambda~5~-phosphol-1-one
- IUPAC
- 1,3,4-trimethyl-2,5-dihydro-1λ5-phosphole 1-oxide
Names & synonyms
15450-80-3DTXSID503101061,3,4-Trimethyl-2,5-dihydro-1H-1lambda~5~-phosphol-1-oneRefChem:217086DTXCID20261232NSC222474SCHEMBL2266224NSC-222474
Database identifiers
- CAS
15450-80-3- PubChem CID
- 312422
- DTXSID
DTXSID50310106
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 185
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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