Trans-4-[ (Dimethylamino) methyl]cyclohexanamine dihydrochloride

CAT: 0127-OR1007514-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR1007514-01Size:1 g

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CAS Number

1356954-01-2

Purity

98%

Smiles

N[C@H]1CC[C@H](CN(C)C)CC1.Cl.Cl

Chemical Information

trans-4-[(Dimethylamino)methyl]cyclohexanamine dihydrochloride

CAS Number	1356954-01-2
PubChem CID	66715761
IUPAC Name	4-[(dimethylamino)methyl]cyclohexan-1-amine;dihydrochloride
Molecular Formula	C9H22Cl2N2
Molecular Weight	229.19
Topological Polar Surface Area	29.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	13
Formal Charge	0
Complexity	104

SMILES

CN(C)CC1CCC(CC1)N.Cl.Cl

InChI

InChI=1S/C9H20N2.2ClH/c1-11(2)7-8-3-5-9(10)6-4-8;;/h8-9H,3-7,10H2,1-2H3;2*1H

InChIKey

CGFHCEZSOGYGJR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1356954-01-2

CID: 66715761

Formula: C9H22Cl2N2

MW: 229.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	229.19
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	228.1160041
Monoisotopic Mass	228.1160041
Topological Polar Surface Area	29.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	104
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	3
Compound Is Canonicalized	Yes

Catalog	Name
OR1034470-01	Trans-4- ((Dimethylamino) methyl) cyclohexanamine diacetate
OR1038377-01	Trans-4- (Benzyloxy) cyclohexanamine
OR1069954-01	Trans-4- (Cyclopropylmethoxy) cyclohexanamine
OR1031777-01	Trans-4- (Cyclopropyloxy) cyclohexanamine
OR1015274-01	Trans-4- (2-Methoxyethoxy) -Cyclohexanamine
PC1026975-01	Trans-4- (Difluoromethyl) cyclohexanamine hydrochloride
OR1992	4-[ (Dimethylamino) methyl]-1-methylpiperidine dihydrochloride
OR1078446-01	4- (Aminomethyl) cyclohexanamine (cis- and trans- mixture)
OR1001267-01	Trans-4- (tert-Butyl) cyclohexanamine hydrochloride
OR78994-01	2-[ (dimethylamino) methyl]pyridin-4-amine dihydrochloride

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