Home Nitriles 2-[3-(aminomethyl)piperidin-1-yl]acetonitrile dihydrochloride

2-[3-(aminomethyl)piperidin-1-yl]acetonitrile dihydrochloride

CAS No.:
1354951-26-0
Catalog Number:
AG01AKSE
Molecular Formula:
C8H17Cl2N3
Molecular Weight:
226.1467
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Product Description
Catalog Number:
AG01AKSE
Chemical Name:
2-[3-(aminomethyl)piperidin-1-yl]acetonitrile dihydrochloride
CAS Number:
1354951-26-0
Molecular Formula:
C8H17Cl2N3
Molecular Weight:
226.1467
MDL Number:
MFCD20233572
IUPAC Name:
2-[3-(aminomethyl)piperidin-1-yl]acetonitrile;dihydrochloride
InChI:
InChI=1S/C8H15N3.2ClH/c9-3-5-11-4-1-2-8(6-10)7-11;;/h8H,1-2,4-7,10H2;2*1H
InChI Key:
JDMVVPJXZANJEM-UHFFFAOYSA-N
SMILES:
NCC1CCCN(C1)CC#N.Cl.Cl
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.08g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
226.145g/mol
Monoisotopic Mass:
225.08g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties