chempirical

N-Boc-1,6-diaminohexane

C11H24N2O2CAS 51857-17-1216.32 g/mol

Open in Covalent MOL file
OONHNH2
Primary amine

Properties

Molecular formula
C11H24N2O2
Molar mass
216.32 g/mol
Exact mass
216.1838 Da
logP
2.23Crippen estimate
Polar surface area
67.8 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
6

Identifiers

CAS number
51857-17-1
SMILES
CC(C)(C)OC(O)=NCCCCCCN
InChIKey
RVZPDKXEHIRFPM-UHFFFAOYSA-N
InChI
InChI=1S/C11H24N2O2/c1-11(2,3)15-10(14)13-9-7-5-4-6-8-12/h4-9,12H2,1-3H3,(H,13,14)

Weigh it out

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

Names and synonyms

19 names · show all
  • Carbamic acid, N-(6-aminohexyl)-, 1,1-dimethylethyl ester
  • Carbamic acid, (6-aminohexyl)-, 1,1-dimethylethyl ester
  • 6-[(tert-Butyloxycarbonyl)amino]hexylamine
  • N-(tert-Butoxycarbonyl)hexamethylenediamine
  • N-(tert-Butoxycarbonyl)-1,6-hexanediamine
  • 1-((tert-Butoxycarbonyl)amino)-6-aminohexane
  • (6-Aminohexyl)carbamic acid tert-butyl ester
  • 6-Aminohexylcarbamic acid tert-butyl ester
  • tert-Butyl N-(6-aminohexyl)carbamate
  • tert-Butyl (6-aminohexyl)carbamate
  • 6-(tert-Butoxycarbonylamino)-1-hexanamine
  • 6-((tert-Butoxycarbonyl)amino)-1-hexylamine
  • N-(tert-Butoxycarbonyl)-1,6-diaminohexane
  • 6-(tert-Butoxycarbonylamino)hexylamine
  • Mono-BOC-hexamethylenediamine
  • tert-Butyloxycarbonyl-1,6-hexamethylenediamine
  • Boc-1,6-hexanediamine
  • N-Boc-1,6-hexanediamine
  • 6-(tert-Butoxycarbonyl)amino-1-aminohexane

Work with N-Boc-1,6-diaminohexane

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-(tert-Butoxycarbonyl)-1,5-diaminopentane51644-96-3100 % similar N-tert-Butoxycarbonyl-1,6-diaminohexane hydrochloride65915-94-891 % similar tert-Butyl (3-aminopropyl)carbamate75178-96-087 % similar 1,1-Dimethylethyl N-(5-hydroxypentyl)carbamate75178-90-469 % similar 1,1-Dimethylethyl 13-amino-5,8,11-trioxa-2-azatridecanoate101187-40-063 % similar 6-[(tert-Butoxycarbonyl)amino]hexanoic acid6404-29-162 % similar Boc-β-alanine3303-84-251 % similar α-tert-Butoxycarbonyl-L-lysine13734-28-651 % similar

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

Elsewhere

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