3,4-Dimethyl-5-Phenyl-1,3-Oxazolidin-2-One

HCID 237192

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 6317-31-3
Standard SMILES: CC1C(c2ccccc2)OC(=O)N1C
InChIKey: MNYARIILPGRTQL-UHFFFAOYSA-N
Molecular formula: C11H13NO2
Average molar mass: 191.23 g/mol
Monoisotopic mass: 191.09462866

Overview

(4S,5R) Ephedroxane is an oxazolidinone.

Names & identifiers

Preferred name: 3,4-Dimethyl-5-Phenyl-1,3-Oxazolidin-2-One
IUPAC: 3,4-dimethyl-5-phenyl-1,3-oxazolidin-2-one

Names & synonyms

3,4-dimethyl-5-phenyl-1,3-oxazolidin-2-oneRefChem:10658076317-31-33,4-Dimethyl-5-phenyloxazolidin-2-oneMLS002608238DTXSID401673833,4-dimethyl-5-phenyl-oxazolidin-2-one(4S,5R) Ephedroxane2-Oxazolidinone, 3,4-dimethyl-5-phenyl-SCHEMBL5286997SCHEMBL9016269CHEMBL2136518

Show more names

DTXSID30285106CHEBI:228934HMS3078D18NSC40497NSC-40497SMR001526989trans-3,4-dimethyl-5-phenyl-2-oxazolidone2-Oxazolidinone, 3,4-dimethyl-5-phenyl-, (4S,5S)-

Database identifiers

CAS: 6317-31-3
PubChem CID: 237192
DTXSID: DTXSID30285106
ChEMBL: CHEMBL2136518
ChEBI: CHEBI:228934

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 29.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 14
Formal charge: 0
Complexity: 223

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…