Basic information
- CAS
54418-69-8- Standard SMILES
CC1NC(=O)OC1c1ccccc1- InChIKey
PPIBJOQGAJBQDF-UHFFFAOYSA-N- Molecular formula
- C10H11NO2
- Average molar mass
- 177.2 g/mol
Names & identifiers
- Preferred name
- 4-Methyl-5-phenyl-1,3-oxazolidin-2-one
- IUPAC
- 4-methyl-5-phenyl-1,3-oxazolidin-2-one
- English name
- 4β-Methyl-5-phenyloxazolidin-2-one
- Molecular formula
- C10H11NO2
- Molecular weight
- 177.2
Names & synonyms
4-Methyl-5-phenyl-1,3-oxazolidin-2-one4-Methyl-5-phenyloxazolidin-2-one4-methyl-5-phenyl-oxazolidin-2-one54418-69-8(4R,5S)-4-Methyl-5-phenyl-2-oxazolidinone2-Oxazolidinone, 4-methyl-5-phenyl-, (4R,5S)-rel-4-methyl-5-phenyl-2-oxazolidinoneNCIOpen2_000611CBiol_000537SCHEMBL3381914-methyl-5-phenyloxazolidinonemethyl-5-phenyl-2-oxazolidinone
Show more names
4β-Methyl-5-phenyloxazolidin-2-one2-Oxazolidinone, 4-methyl-5-phenyl-
NSC69199ICCB3_000185NSC-69199SBB067625AKOS015913862LS-13771NS00124447(4S,5R)-(?)-4-Methyl-5-phenyl-2-oxazolidinone
Database identifiers
- CAS
54418-69-8- PubChem CID
- 250174
- Nikkaji
- J24.430I
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 199
Physicochemical properties
- Boiling point
- 395.8 · 395.8±22.0 °C(Predicted)
- Density
- 1.132 · 1.132±0.06 g/cm3(Predicted)
- pka
- 12.35 · 12.35±0.60(Predicted)
Related reactions
46 records
Compound notes
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