chempirical

(S)-(+)-4-Phenyl-2-oxazolidinone

C9H9NO2CAS 99395-88-7163.18 g/mol

Open in Covalent MOL file
ONHO

Properties

Molecular formula
C9H9NO2
Molar mass
163.18 g/mol
Exact mass
163.0633 Da
Melting point
124–126 °C
logP
1.67Crippen estimate
Polar surface area
41.8 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
99395-88-7
SMILES
OC1=N[C@@H](c2ccccc2)CO1
InChIKey
QDMNNMIOWVJVLY-MRVPVSSYSA-N
InChI
InChI=1S/C9H9NO2/c11-9-10-8(6-12-9)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,10,11)/t8-/m1/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names
  • 2-Oxazolidinone, 4-phenyl-, (4S)-
  • 2-Oxazolidinone, 4-phenyl-, (S)-
  • (4S)-4-Phenyl-2-oxazolidinone
  • (S)-4-Phenyl-2-oxazolidinone
  • (+)-4-Phenyl-2-oxazolidinone
  • (S)-POZ
  • (S)-4-Phenyl-1,3-oxazolidin-2-one
  • (4S)-4-Phenyloxazolidin-2-one
  • (4S)-4-Phenyl-1,3-oxazolidin-2-one

Work with (S)-(+)-4-Phenyl-2-oxazolidinone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(-)-4-Phenyl-2-oxazolidinone90319-52-1100 % similar (R)-4-Benzyl-2-oxazolidinone102029-44-756 % similar (S,S)-2,2-Bis(4-phenyl-2-oxazolin-2-yl)propane131457-46-056 % similar (-)-4-Benzyl-2-oxazolidinone90719-32-756 % similar (R,R)-2,6-Bis(4-phenyl-2-oxazolin-2-yl)pyridine128249-70-753 % similar 1,1-Dimethylethyl N-[(1R)-2-hydroxy-1-phenylethyl]carbamate102089-74-751 % similar 1,1-Dimethylethyl N-[(1R)-2-[(methylsulfonyl)oxy]-1-phenylethyl]carbamate102089-75-849 % similar β-[[(1,1-Dimethylethoxy)carbonyl]amino]benzenepropanoic acid14676-01-847 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2,6-Diacetylpyridine1129-30-2 1-Phenyl-1,2-propanedione 2-oxime119-51-7 4-Acetamidobenzaldehyde122-85-0 (3R,4S)-3-Hydroxy-4-phenyl-2-azetidinone132127-34-5 (±)-Indoline-2-carboxylic acid16851-56-2 2,6-Dimethoxybenzonitrile16932-49-3 2,5-Dimethyl-β-oxo-3-furanpropanenitrile175276-62-7 3,5-Dimethoxybenzonitrile19179-31-8

Elsewhere

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