2-(((Benzyloxy)carbonyl)amino)-2-hydroxyacetic acid

C₁₀H₁₁NO₅CAS 56538-57-9225.20 g/mol

Open in Covalent MOL file

Alcohol Carbamate Carboxylic acid

Properties

Molecular formula: C₁₀H₁₁NO₅
Molar mass: 225.20 g/mol
Exact mass: 225.0637 Da
logP: 0.32Crippen estimate
Polar surface area: 95.9 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 4

Hazards

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

Identifiers

CAS number

56538-57-9

SMILES

C1=CC=C(C=C1)COC(=O)NC(C(=O)O)O

InChIKey

JQEZLSUFDXSIEK-UHFFFAOYSA-N

InChI

InChI=1S/C10H11NO5/c12-8(9(13)14)11-10(15)16-6-7-4-2-1-3-5-7/h1-5,8,12H,6H2,(H,11,15)(H,13,14)

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Names and synonyms

1 names

2-([(Benzyloxy)carbonyl]amino)-2-hydroxyacetic acid

Work with 2-(((Benzyloxy)carbonyl)amino)-2-hydroxyacetic acid

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

Z-Phg-oh53990-33-371 % similar N-Cbz-D-alanine26607-51-269 % similar 4-(((Benzyloxy)(hydroxy)methylidene)amino)cyclohexane-1-carboxylic acid34771-04-567 % similar N-Cbz-D-serine6081-61-467 % similar Z-D-Thr-oh80384-27-667 % similar Cbz-D-valine1685-33-266 % similar N-Carbobenzoxy-dl-aspartic acid4515-21-364 % similar Cbz-L-tert-leucine62965-10-064 % similar

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

Same formula

(2R,3R)-Tartranilic acid3019-58-7 3-Nitro-4-propoxybenzoic acid35288-44-9 1-(4,5-Dimethoxy-2-nitrophenyl)ethanone4101-32-0

Elsewhere

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