Hexanediamine dihydrochloride

C6H18Cl2N2CAS 6055-52-3189.12 g/mol

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HClHClH2NNH2
Primary amine

Properties

Molecular formula
C6H18Cl2N2
Molar mass
189.12 g/mol
Exact mass
188.0847 Da
Melting point
248 °C
logP
1.31Crippen estimate
Polar surface area
52.0 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
5

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
6055-52-3
SMILES
Cl.Cl.NCCCCCCN
InChIKey
XMVQMBLTFKAIOX-UHFFFAOYSA-N
InChI
InChI=1S/C6H16N2.2ClH/c7-5-3-1-2-4-6-8;;/h1-8H2;2*1H

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Names and synonyms

5 names
  • 1,6-Hexanediamine, hydrochloride (1:2)
  • 1,6-Hexanediamine, dihydrochloride
  • Hexamethylenediamine dihydrochloride
  • 1,6-Diaminohexane dihydrochloride
  • 1,6-Hexamethylenediamine dihydrochloride

Work with Hexanediamine dihydrochloride

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.

Hexamethylenediamine124-09-4Free base

Similar compounds

1,5-Diaminopentane dihydrochloride1476-39-7100 % similar Putrescine dihydrochloride333-93-792 % similar 1,3-Diaminopropane dihydrochloride10517-44-977 % similar 1,12-Dodecanediamine2783-17-775 % similar Octamethylenediamine373-44-475 % similar Cadaverine462-94-275 % similar 1,7-Heptanediamine646-19-575 % similar 1,9-Nonanediamine646-24-275 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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