Home Nitriles 3-(3-AMino-1H-pyrazol-1-yl)propanenitrile

3-(3-AMino-1H-pyrazol-1-yl)propanenitrile

CAS No.:
58876-75-8
Catalog Number:
AG00EKWH
Molecular Formula:
C6H8N4
Molecular Weight:
136.1545
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Product Description
Catalog Number:
AG00EKWH
Chemical Name:
3-(3-AMino-1H-pyrazol-1-yl)propanenitrile
CAS Number:
58876-75-8
Molecular Formula:
C6H8N4
Molecular Weight:
136.1545
MDL Number:
MFCD16664594
IUPAC Name:
3-(3-aminopyrazol-1-yl)propanenitrile
InChI:
InChI=1S/C6H8N4/c7-3-1-4-10-5-2-6(8)9-10/h2,5H,1,4H2,(H2,8,9)
InChI Key:
MHMTZDHAMDKMIJ-UHFFFAOYSA-N
SMILES:
Nc1ccn(n1)CCC#N
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.075g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
136.158g/mol
Monoisotopic Mass:
136.075g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties