(R)-(-)-4-Benzyl-3-propionyl-2-oxazolidinone

C13H15NO3CAS 131685-53-5233.27 g/mol

Open in Covalent MOL file
ONOO
AmideCarbamate

Properties

Molecular formula
C13H15NO3
Molar mass
233.27 g/mol
Exact mass
233.1052 Da
logP
1.99Crippen estimate
Polar surface area
46.6 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
3
Stereocentres
Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
131685-53-5
SMILES
CCC(=O)N1[C@@H](COC1=O)CC2=CC=CC=C2
InChIKey
WHOBYFHKONUTMW-LLVKDONJSA-N
InChI
InChI=1S/C13H15NO3/c1-2-12(15)14-11(9-17-13(14)16)8-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3/t11-/m1/s1

Weigh it out

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

Work with (R)-(-)-4-Benzyl-3-propionyl-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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(4S)-(+)-4-Benzyl-3-propionyl-2-oxazolidinone101711-78-8Enantiomer

Similar compounds

(S)-(+)-3-Acetyl-4-benzyl-2-oxazolidinone132836-66-967 % similar (4S)-3-(1-Oxopropyl)-4-phenyl-2-oxazolidinone184363-66-464 % similar (S)-(+)-4-Isopropyl-3-propionyl-2-oxazolidinone77877-19-149 % similar (4R)-3-Propanoyl-4-(propan-2-yl)-1,3-oxazolidin-2-one89028-40-049 % similar 1-(4-Benzoyl-1-piperazinyl)-1-propanone314728-85-343 % similar 2-Phenethyl propionate122-70-342 % similar 1,3-Diethyl 2-(phenylmethyl)propanedioate607-81-840 % similar Benzyl propionate122-63-440 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Mecarbinate15574-49-9 3-(Cyclopentyloxy)-4-methoxyphenyl isocyanate185300-51-0 Benzyl 4-oxo-1-piperidinecarboxylate19099-93-5 3-Formyl-pyrrolidine-1-carboxylicacidbenzylester276872-86-7 N-Boc-5-hydroxyindole434958-85-7 Methyl 1-benzyl-5-oxo-3-pyrrolidinecarboxylate51535-00-3 1-Benzoylpiperidine-4-carboxylic acid5274-99-7

Elsewhere

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