chempirical

1,1-Dimethylethyl N-(2-amino-2-oxoethyl)carbamate

C7H14N2O3CAS 35150-09-5174.20 g/mol

Open in Covalent MOL file
OONHNH2O

Properties

Molecular formula
C7H14N2O3
Molar mass
174.20 g/mol
Exact mass
174.1004 Da
Melting point
85–87 °C
logP
1.25Crippen estimate
Polar surface area
85.9 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
2

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
35150-09-5
SMILES
CC(C)(C)OC(O)=NCC(=N)O
InChIKey
RHONTQZNLFIDCQ-UHFFFAOYSA-N
InChI
InChI=1S/C7H14N2O3/c1-7(2,3)12-6(11)9-4-5(8)10/h4H2,1-3H3,(H2,8,10)(H,9,11)

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Names and synonyms

5 names
  • Carbamic acid, N-(2-amino-2-oxoethyl)-, 1,1-dimethylethyl ester
  • Carbamic acid, (2-amino-2-oxoethyl)-, 1,1-dimethylethyl ester
  • N-(tert-Butoxycarbonyl)glycine amide
  • Boc-glycinamide
  • tert-Butyl N-(2-amino-2-oxoethyl)carbamate

Work with 1,1-Dimethylethyl 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

N-[(1,1-Dimethylethoxy)carbonyl]glycine 1,1-dimethylethyl ester111652-20-159 % similar N-(tert-Butoxycarbonyl)glycine4530-20-559 % similar N-Boc-ethylenediamine57260-73-851 % similar 1,2-Bis(1,1-dimethylethyl) 1,2-hydrazinedicarboxylate16466-61-850 % similar tert-Butoxycarbonyl-L-asparagine7536-55-250 % similar tert-Butyl (3-aminopropyl)carbamate75178-96-049 % similar Boc-L-glutamine13726-85-748 % similar N-(tert-Butyloxycarbonyl)glycine N-hydroxysuccinimide ester3392-07-248 % similar

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

Same formula

Gly-D-val10521-49-0 Nε-Formyl-L-lysine1190-48-3 Glycyl-L-valine1963-21-9 Glycyl-DL-valine2325-17-9 L-Theanine3081-61-6

Elsewhere

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