chempirical

Phenylmethyl N-(2-amino-2-oxoethyl)carbamate

C10H12N2O3CAS 949-90-6208.22 g/mol

Open in Covalent MOL file
NH2ONHOO

Properties

Molecular formula
C10H12N2O3
Molar mass
208.22 g/mol
Exact mass
208.0848 Da
Melting point
144 °C
logP
1.65Crippen estimate
Polar surface area
85.9 Ų
H-bond donors / acceptors
3 / 3
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
949-90-6
SMILES
N=C(O)CN=C(O)OCc1ccccc1
InChIKey
HQYMUNCIMNFLDT-UHFFFAOYSA-N
InChI
InChI=1S/C10H12N2O3/c11-9(13)6-12-10(14)15-7-8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,11,13)(H,12,14)

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Names and synonyms

10 names
  • Carbamic acid, N-(2-amino-2-oxoethyl)-, phenylmethyl ester
  • Carbamic acid, (carbamoylmethyl)-, benzyl ester
  • Carbamic acid, (2-amino-2-oxoethyl)-, phenylmethyl ester
  • Carbobenzoxyglycinamide
  • N-Benzyloxycarbonylglycinamide
  • Benzyloxycarbonylglycinamide
  • N-Benzyloxycarbonylglycine amide
  • NSC 88477
  • Cbz-glycinamide
  • Benzyl (2-amino-2-oxoethyl)carbamate

Work with Phenylmethyl N-(2-amino-2-oxoethyl)carbamate

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

Benzyloxycarbonylglycine1138-80-364 % similar N-Benzyloxycarbonylglycine methyl ester1212-53-958 % similar Benzyl N-hydroxycarbamate3426-71-957 % similar N2-[(Phenylmethoxy)carbonyl]-L-glutamine2650-64-856 % similar N2-[(Phenylmethoxy)carbonyl]-L-asparagine2304-96-355 % similar Phenylmethyl hydrazinecarboxylate5331-43-155 % similar N-(Benzyloxycarbonyl)-β-alanine2304-94-153 % similar Carbobenzoxyglycine N-hydroxysuccinimide ester2899-60-753 % similar

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

Same formula

4-(4-Nitrophenyl)morpholine10389-51-2 D-Kynurenine13441-51-5 L-Kynurenine2922-83-0 Kynurenine343-65-7 4-((3-Pyridinylcarbonyl)amino)butanoic acid34562-97-5 N-Acetyl-2-(4-nitrophenyl)ethylamine6270-07-1 N-(4-Aminobenzoyl)-beta-alanine7377-08-4

Elsewhere

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