Home Nitriles 2-[trans-4-aminocyclohexyl]acetonitrilehydrochloride

2-[trans-4-aminocyclohexyl]acetonitrilehydrochloride

CAS No.:
1313279-48-9
Catalog Number:
AG00IKSK
Molecular Formula:
C8H15ClN2
Molecular Weight:
174.6711
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Product Description
Catalog Number:
AG00IKSK
Chemical Name:
2-[trans-4-aminocyclohexyl]acetonitrilehydrochloride
CAS Number:
1313279-48-9
Molecular Formula:
C8H15ClN2
Molecular Weight:
174.6711
MDL Number:
MFCD30146461
IUPAC Name:
2-(4-aminocyclohexyl)acetonitrile;hydrochloride
InChI:
InChI=1S/C8H14N2.ClH/c9-6-5-7-1-3-8(10)4-2-7;/h7-8H,1-5,10H2;1H
InChI Key:
PVCCBMZCSWIUCI-UHFFFAOYSA-N
SMILES:
N[C@@H]1CC[C@H](CC1)CC#N.Cl
Properties
Complexity:
137  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.092g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
174.672g/mol
Monoisotopic Mass:
174.092g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties