Basic information
- CAS
58482-85-2- Standard SMILES
CC1N=C(Cc2ccccc2)OC1=O- InChIKey
MPRJDQMHTHKAKE-UHFFFAOYSA-N- Molecular formula
- C11H11NO2
- Average molar mass
- 189.21 g/mol
- Monoisotopic mass
- 189.07897859
Names & identifiers
- Preferred name
- 5(4H)-Oxazolone, 4-methyl-2-(phenylmethyl)-
- IUPAC
- 2-benzyl-4-methyl-4H-1,3-oxazol-5-one
Names & synonyms
58482-85-25(4H)-Oxazolone, 4-methyl-2-(phenylmethyl)-DTXSID80482224RefChem:298061DTXCID804330342-benzyl-4-methyloxazol-5(4H)-oneSCHEMBL40230132-Benzyl-4-methyl-1,3-oxazol-5(4H)-one
Database identifiers
- CAS
58482-85-2- PubChem CID
- 12246765
- DTXSID
DTXSID80482224- Nikkaji
- J2.101.944E
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 254
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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