chempirical

1,12-Dodecanediamine

C12H28N2CAS 2783-17-7200.37 g/mol

Open in Covalent MOL file
H2NNH2
Primary amine

Properties

Molecular formula
C12H28N2
Molar mass
200.37 g/mol
Exact mass
200.2252 Da
Melting point
66–67 °C
Boiling point
187 °C
logP
2.80Crippen estimate
Polar surface area
52.0 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
11

Identifiers

CAS number
2783-17-7
SMILES
NCCCCCCCCCCCCN
InChIKey
QFTYSVGGYOXFRQ-UHFFFAOYSA-N
InChI
InChI=1S/C12H28N2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h1-14H2

Weigh it out

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

Names and synonyms

8 names
  • 1,12-Dodecamethylenediamine
  • 1,12-Diaminododecane
  • Dodecamethylenediamine
  • 1,12-Dodecylenediamine
  • 1,12-n-Dodecanediamine
  • 1,12-Diamino-n-dodecane
  • NSC 55050
  • NSC 59861

Work with 1,12-Dodecanediamine

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Hexamethylenediamine124-09-4100 % similar Octamethylenediamine373-44-4100 % similar Cadaverine462-94-2100 % similar 1,7-Heptanediamine646-19-5100 % similar 1,9-Nonanediamine646-24-2100 % similar Putrescine110-60-189 % similar 1,5-Diaminopentane dihydrochloride1476-39-775 % similar Hexanediamine dihydrochloride6055-52-375 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook