Home Nitriles 2-(4-methylpiperazin-1-yl)propanenitrile hydrochloride

2-(4-methylpiperazin-1-yl)propanenitrile hydrochloride

CAS No.:
1221725-29-6
Catalog Number:
AG01A86C
Molecular Formula:
C8H16ClN3
Molecular Weight:
189.6857
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Product Description
Catalog Number:
AG01A86C
Chemical Name:
2-(4-methylpiperazin-1-yl)propanenitrile hydrochloride
CAS Number:
1221725-29-6
Molecular Formula:
C8H16ClN3
Molecular Weight:
189.6857
MDL Number:
MFCD15209640
IUPAC Name:
2-(4-methylpiperazin-1-yl)propanenitrile;hydrochloride
InChI:
InChI=1S/C8H15N3.ClH/c1-8(7-9)11-5-3-10(2)4-6-11;/h8H,3-6H2,1-2H3;1H
InChI Key:
HVLHAMGGGXIJHX-UHFFFAOYSA-N
SMILES:
CC(N1CCN(CC1)C)C#N.Cl
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.103g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.687g/mol
Monoisotopic Mass:
189.103g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
30.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties