(S)-(-)-4-Benzyloxazolidine-2,5-dione

C₁₀H₉NO₃CAS 14825-82-2191.19 g/mol

Open in Covalent MOL file

Acid anhydride Carbamate

Properties

Molecular formula: C₁₀H₉NO₃
Molar mass: 191.19 g/mol
Exact mass: 191.0582 Da
logP: 0.86Crippen estimate
Polar surface area: 55.4 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

14825-82-2

SMILES

C1=CC=C(C=C1)C[C@H]2C(=O)OC(=O)N2

InChIKey

GQBIVYSGPXCELZ-QMMMGPOBSA-N

InChI

InChI=1S/C10H9NO3/c12-9-8(11-10(13)14-9)6-7-4-2-1-3-5-7/h1-5,8H,6H2,(H,11,13)/t8-/m0/s1

Weigh it out

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

Names and synonyms

1 names

(4S)-4-Benzyl-1,3-oxazolidine-2,5-dione

Work with (S)-(-)-4-Benzyloxazolidine-2,5-dione

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

1,3-Diethyl 2-(phenylmethyl)propanedioate607-81-844 % similar N-Boc-3-iodo-L-alanine benzyl ester108957-20-643 % similar Boc-D-4,4'-biphenylalanine128779-47-543 % similar Methyl (αS)-α-hydroxybenzenepropanoate13673-95-543 % similar Phenylalanine methyl ester2577-90-443 % similar Benzyl 3-oxocyclobutylcarbamate130369-36-742 % similar Z-D-Gln-oh13139-52-141 % similar Boc-D-bpa-oh117666-94-141 % similar

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

Same formula

5-Methoxy-1H-indole-3-carboxylic acid10242-01-0 4-Methoxy-1H-indole-2-carboxylic acid103260-65-7 7-Methoxy-1H-indole-3-carboxylic acid128717-77-1 5-Hydroxyindoleacetic acid1321-73-9 2-Oxo-2,3-dihydro-1H-indole-6-carboxylic acid methyl ester14192-26-8 6-Methoxy-1H-indole-2-carboxylic acid16732-73-3 N-(2-Hydroxyethyl)phthalimide3891-07-4 7-Nitro-1-tetralone40353-34-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook