chempirical

1,2-Diaminocyclohexane

C6H14N2CAS 694-83-7114.19 g/mol

Open in Covalent MOL file
H2NH2N
Primary amine

Properties

Molecular formula
C6H14N2
Molar mass
114.19 g/mol
Exact mass
114.1157 Da
Boiling point
92–93 °C
logP
0.21Crippen estimate
Polar surface area
52.0 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Identifiers

CAS number
694-83-7
SMILES
NC1CCCCC1N
InChIKey
SSJXIUAHEKJCMH-UHFFFAOYSA-N
InChI
InChI=1S/C6H14N2/c7-5-3-1-2-4-6(5)8/h5-6H,1-4,7-8H2

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

Names and synonyms

5 names
  • 1,2-Cyclohexanediamine
  • Dytek DCH 99
  • DHC 99
  • DCH 99
  • Resoltech 1805

Work with 1,2-Diaminocyclohexane

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

cis-1,2-Cyclohexanediamine1436-59-5100 % similar (-)-trans-1,2-Diaminocyclohexane20439-47-8100 % similar (+)-trans-1,2-Diaminocyclohexane21436-03-3100 % similar 2-Methylcyclohexylamine7003-32-956 % similar (1R,2R)-2-Aminocyclohexanol931-16-856 % similar Oxaliplatin61825-94-348 % similar (Sp-4-2)-[rel-(1R,2R)-1,2-cyclohexanediamine-κN1,κN2][ethanedioato(2-)-κO1,κO2]platinum63121-00-648 % similar Cyclopentylamine1003-03-847 % similar

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

Same formula

2,5-Dimethylpiperazine106-55-8 1,4-Dimethylpiperazine106-58-1 2,6-Dimethylpiperazine108-49-6 trans-1,2-Diaminocyclohexane1121-22-8 1-Methyl-3-pyrrolidinemethanamine13005-11-3 (3S)-(-)-3-(Dimethylamino)pyrrolidine132883-44-4 (3R)-(+)-3-(Dimethylamino)pyrrolidine132958-72-6 2-Ethylpiperazine13961-37-0

Elsewhere

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