2-Ethyl-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphospholan-2-one
Basic information
- CAS
39770-48-4- Standard SMILES
CCP1(=O)OC(C)(C)CC1(C)O- InChIKey
OWSLIKTYMPKFHD-UHFFFAOYSA-N- Molecular formula
- C8H17O3P
- Average molar mass
- 192.19 g/mol
- Monoisotopic mass
- 192.0915314
Names & identifiers
- Preferred name
- 2-Ethyl-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphospholan-2-one
- IUPAC
- 2-ethyl-3,5,5-trimethyl-2-oxo-1,2λ5-oxaphospholan-3-ol
Names & synonyms
DTXSID409603512-Ethyl-3-hydroxy-3,5,5-trimethyl-1,2lambda~5~-oxaphospholan-2-oneRefChem:1063036DTXCID601388211trans-2-Ethyl-3,5,5-trimethyl-1,2-oxaphospholan-3-ol 2-oxide39770-48-41,2-OXAPHOSPHOLAN-3-OL, 2-ETHYL-3,5,5-TRIMETHYL-, 2-OXIDE, trans-2-ethyl-2-oxo-3,5,5-trimethyl-1,2-oxaphospholan-3-ol
Database identifiers
- CAS
39770-48-4- PubChem CID
- 38334
- DTXSID
DTXSID40960351
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 236
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Compound notes
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