Basic information
- CAS
70287-40-0- Standard SMILES
C[C@@H]1[C@H](c2ccccc2)OCN1C- InChIKey
POZQVPIDBKNJTK-MWLCHTKSSA-N- Molecular formula
- C11H15NO
- Average molar mass
- 177.24 g/mol
- Monoisotopic mass
- 177.1153641
Names & identifiers
- Preferred name
- (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine
- IUPAC
- (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine
Names & synonyms
70287-40-0AC1L7Q49(4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidineINDICINE-N-OXIDE DERIV (+)DTXSID10320923NSC354434NSC366363NSC-354434NSC-366363Oxazolidine,4-dimethyl-5-phenyl-, cis-Oxazolidine,4-dimethyl-5-phenyl-, (4R-cis)-
Database identifiers
- CAS
70287-40-0- PubChem CID
- 339501
- DTXSID
DTXSID10320923
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 165
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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