Basic information
- CAS
81777-94-8- Standard SMILES
CC1(C)CON(Cc2ccccc2)C1=O- InChIKey
XXIJGIHWGYOAQO-UHFFFAOYSA-N- Molecular formula
- C12H15NO2
- Average molar mass
- 205.25 g/mol
- Monoisotopic mass
- 205.11027872
Names & identifiers
- Preferred name
- 2-Benzyl-4,4-dimethyl-1,2-oxazolidin-3-one
- IUPAC
- 2-benzyl-4,4-dimethyl-1,2-oxazolidin-3-one
Names & synonyms
81777-94-82-benzyl-4,4-dimethyl-1,2-oxazolidin-3-oneDTXSID50526124RefChem:256549DTXCID604769292-Benzyl-4,4-dimethylisoxazolidin-3-oneSCHEMBL7613547
Database identifiers
- CAS
81777-94-8- PubChem CID
- 13192569
- DTXSID
DTXSID50526124
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 244
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…