Oxaliplatin Impurity 20

CAT: 1299-RM-O241220-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-O241220-01Size:10 mg

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CAS Number

1436-59-5

Synonyms

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

Molecular Formula

C6H14N2

Molecular Weight

114.19

Chemical Information

1,2-Diaminocyclohexane, cis-

CAS Number	1436-59-5
PubChem CID	342917
IUPAC Name	cis-(1S,2R)-cyclohexane-1,2-diamine
Molecular Formula	C6H14N2
Molecular Weight	114.19
XLogP	-0.3
Topological Polar Surface Area	52
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	8
Formal Charge	0
Complexity	62

SMILES

C1CC[C@@H]([C@@H](C1)N)N

InChI

InChI=1S/C6H14N2/c7-5-3-1-2-4-6(5)8/h5-6H,1-4,7-8H2/t5-,6+

InChIKey

SSJXIUAHEKJCMH-OLQVQODUSA-N

Chemical Structure

2D Structure

CAS: 1436-59-5

CID: 342917

Formula: C6H14N2

MW: 114.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	114.19
XLogP3	-0.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	114.115698455
Monoisotopic Mass	114.115698455
Topological Polar Surface Area	52 Å²
Heavy Atom Count	8
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	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-O01580-01	Oxaliplatin Impurity 2
KL-02-01624	Oxaliplatin EP Impurity A
IO159550-01	Oxaliplatin Impurity E
AR-O01583-01	Oxaliplatin Impurity 3
AR-O01582-01	Oxaliplatin EP Impurity C
AR-O08880-01	Oxaliplatin EP Impurity B
AR-O01578-01	Oxaliplatin EP Impurity D
AR-O01581-01	Oxaliplatin EP Impurity E
AR-O09000-01	Oxaliplatin S, S-Enantiomer Impurity
A8648-100	Oxaliplatin