chempirical

N-(tert-Butoxycarbonyl)glycine

C7H13NO4CAS 4530-20-5175.18 g/mol

Open in Covalent MOL file
OONHOOH
Carboxylic acid

Properties

Molecular formula
C7H13NO4
Molar mass
175.18 g/mol
Exact mass
175.0845 Da
Melting point
879 °C
logP
0.80Crippen estimate
Polar surface area
79.1 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2

Identifiers

CAS number
4530-20-5
SMILES
CC(C)(C)OC(O)=NCC(=O)O
InChIKey
VRPJIFMKZZEXLR-UHFFFAOYSA-N
InChI
InChI=1S/C7H13NO4/c1-7(2,3)12-6(11)8-4-5(9)10/h4H2,1-3H3,(H,8,11)(H,9,10)

Weigh it out

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

Names and synonyms

16 names · show all
  • 2-[(2-Methylpropan-2-yl)oxycarbonylamino]acetic acid
  • Glycine, N-[(1,1-dimethylethoxy)carbonyl]-
  • Glycine, N-carboxy-, N-tert-butyl ester
  • N-[(1,1-Dimethylethoxy)carbonyl]glycine
  • N-t-Butyloxycarbonylglycine
  • Nα-tert-Butyloxycarbonylglycine
  • N-[(tert-Butyloxy)carbonyl]glycine
  • (tert-Butoxycarbonyl)aminoacetic acid
  • N-BOC-glycine
  • 2-(tert-Butoxycarbonylamino)acetic acid
  • NSC 127669
  • N-[[(1,1-Dimethylethyl)oxy]carbonyl]glycine
  • N-tert-Butoxycarbonyl-2-aminoacetic acid
  • Boc-L-glycine
  • (tert-Butoxycarbonyl)glycine
  • Boc-glycine

Work with N-(tert-Butoxycarbonyl)glycine

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

Boc-β-alanine3303-84-270 % similar N-[(1,1-Dimethylethoxy)carbonyl]glycine 1,1-dimethylethyl ester111652-20-169 % similar 6-[(tert-Butoxycarbonyl)amino]hexanoic acid6404-29-162 % similar Polyethylene glycol 2-(tert-butoxycarbonylamino)ethyl 2-carboxylethyl ether187848-68-659 % similar 1-(1,1-Dimethylethyl) 5,8,11,14-tetraoxa-2-azaheptadecanedioate756525-91-459 % similar 1,1-Dimethylethyl N-(2-amino-2-oxoethyl)carbamate35150-09-559 % similar (3R)-3-[[(1,1-Dimethylethoxy)carbonyl]amino]butanoic acid159991-23-855 % similar N-(tert-Butyloxycarbonyl)glycine N-hydroxysuccinimide ester3392-07-255 % similar

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

Same formula

Ethyl L-glutamate1119-33-1 N-[Tris(hydroxymethyl)methyl]acrylamide13880-05-2 Valienamine38231-86-6 2-Aminopimelic acid627-76-9 Diethyl aminomalonate6829-40-9 N-(Methoxycarbonyl)-L-valine74761-42-5

Elsewhere

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