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10027-80-2 | 1,2-Cyclohexanediamine, hydrochloride (1:2), (1R,2S)-rel-
CAS No: 10027-80-2 Catalog No: AG0001FP MDL No:MFCD19440709
Product Description
Catalog Number:
AG0001FP
Chemical Name:
1,2-Cyclohexanediamine, hydrochloride (1:2), (1R,2S)-rel-
CAS Number:
10027-80-2
Molecular Formula:
C6H16Cl2N2
Molecular Weight:
187.1106
MDL Number:
MFCD19440709
IUPAC Name:
(1S,2R)-cyclohexane-1,2-diamine;dihydrochloride
InChI:
InChI=1S/C6H14N2.2ClH/c7-5-3-1-2-4-6(5)8;;/h5-6H,1-4,7-8H2;2*1H/t5-,6+;;
InChI Key:
HEKOZXSZLOBKGM-RUTFAPCESA-N
SMILES:
N[C@@H]1CCCC[C@@H]1N.Cl.Cl
Properties
Complexity:
62.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
186.069g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
187.108g/mol
Monoisotopic Mass:
186.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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