1,2-Cyclohexanediamine, dihydrochloride, (1R,2S)-rel-


Chemical Name: 1,2-Cyclohexanediamine, dihydrochloride, (1R,2S)-rel-
CAS Number: 10027-80-2
Product Number: AG0001FP(AGN-PC-0OPKIF)
Synonyms:
MDL No:
Molecular Formula: C6H16Cl2N2
Molecular Weight: 187.1106

Identification/Properties


Properties
MP:
307-310℃
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
187.108g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
186.069g/mol
Monoisotopic Mass:
186.069g/mol
Topological Polar Surface Area:
52A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
62.9
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
3
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


PNMR/1R2S-rel-12-Cyclohexanediaminedihydrochloride-10027-80-2-hnmr.pdf

Other Analytical Data


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Chemical Structure



(1R,2S)-Cyclohexane-1,2-diamine dihydrochloride is a versatile compound widely utilized in chemical synthesis. This chiral diamine serves as a valuable building block in the creation of complex molecules due to its unique stereochemistry. Its application in asymmetric synthesis enables the formation of enantiopure compounds, crucial in the pharmaceutical and agrochemical industries. The selective coordination properties of (1R,2S)-Cyclohexane-1,2-diamine dihydrochloride make it a favored reagent for catalytic processes, leading to efficient and environmentally friendly production routes. Its role in the preparation of ligands for transition metal-catalyzed reactions further highlights its importance in modern synthetic chemistry.