1,2-Cyclohexanediamine, (1R,2R)-,(2R,3R)-2,3-dihydroxybutanedioate (1:1)


Chemical Name: 1,2-Cyclohexanediamine, (1R,2R)-,(2R,3R)-2,3-dihydroxybutanedioate (1:1)
CAS Number: 39961-95-0
Product Number: AG003BG5(AGN-PC-0RLC4K)
Synonyms:
MDL No: MFCD00191979
Molecular Formula: C10H20N2O6
Molecular Weight: 264.2756

Identification/Properties


Properties
MP:
273 °C (dec.)(lit.)
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
12 ° (C=2.5, H2O)
Computed Properties
Molecular Weight:
264.278g/mol
Hydrogen Bond Donor Count:
6
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
3
Exact Mass:
264.132g/mol
Monoisotopic Mass:
264.132g/mol
Topological Polar Surface Area:
167A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
197
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302+H312+H332-H315-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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