chempirical

Epsilon-tert-Butyloxycarbonyl-lysine

C11H22N2O4CAS 13734-28-6246.31 g/mol

Open in Covalent MOL file
OONHNH2OHO
CarbamateCarboxylic acidPrimary amine

Properties

Molecular formula
C11H22N2O4
Molar mass
246.31 g/mol
Exact mass
246.1580 Da
Melting point
195–196 °C
logP
1.30Crippen estimate
Polar surface area
105.1 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
6
Stereocentres
Sin SMILES atom order

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
13734-28-6
SMILES
CC(C)(C)OC(O)=N[C@@H](CCCCN)C(=O)O
InChIKey
DQUHYEDEGRNAFO-QMMMGPOBSA-N
InChI
InChI=1S/C11H22N2O4/c1-11(2,3)17-10(16)13-8(9(14)15)6-4-5-7-12/h8H,4-7,12H2,1-3H3,(H,13,16)(H,14,15)/t8-/m0/s1

Weigh it out

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

Names and synonyms

16 names · show all
  • α-tert-Butoxycarbonyl-L-lysine
  • L-Lysine, N2-[(1,1-dimethylethoxy)carbonyl]-
  • Lysine, N2-carboxy-, N2-tert-butyl ester, L-
  • N2-[(1,1-Dimethylethoxy)carbonyl]-L-lysine
  • N2-tert-Butoxycarbonyl-L-lysine
  • BOC-Lys-OH
  • α-N-tert-Butoxycarbonyl-L-lysine
  • Nα-BOC-L-lysine
  • NSC 343721
  • α-N-Boc-lysine
  • N-α-(tert-Butoxycarbonyl)-L-lysine
  • (S)-6-Amino-2-(tert-butoxycarbonylamino)hexanoic acid
  • N-tert-Butoxycarbonyllysine
  • BOC-L-Lys-OH
  • (2S)-6-Amino-2-[[(tert-butoxy)carbonyl]amino]hexanoic acid
  • (2S)-6-Azaniumyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate

Work with Epsilon-tert-Butyloxycarbonyl-lysine

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Boc-D-lys-oh106719-44-2Enantiomer

Similar compounds

N-[(1,1-Dimethylethoxy)carbonyl]-D-norleucine55674-63-072 % similar N-tert-Butoxycarbonyl-L-norleucine6404-28-072 % similar N-[(1,1-Dimethylethoxy)carbonyl]-L-homoserine41088-86-267 % similar N2-[(1,1-Dimethylethoxy)carbonyl]-N6-formyl-L-lysine2483-47-867 % similar 5-(1,1-Dimethylethyl) hydrogen N-[(1,1-dimethylethoxy)carbonyl]-L-glutamate13726-84-666 % similar L-Norleucine, N-[(1,1-dimethylethoxy)carbonyl]-, compd. with N-cyclohexylcyclohexanamine (1:1)21947-32-064 % similar 5-Cyclohexyl hydrogen N-[(1,1-dimethylethoxy)carbonyl]-L-glutamate73821-97-363 % similar Boc-L-methionine2488-15-563 % similar

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

Same formula

1-Boc-piperazine acetate143238-38-4 N-Epsilon-boc-D-lysine31202-69-4

Elsewhere

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