Home Nitriles Propionitrile, 3-(3-pyridylamino)- (6CI)

Propionitrile, 3-(3-pyridylamino)- (6CI)

CAS No.:
101257-92-5
Catalog Number:
AG009RZP
Molecular Formula:
C8H9N3
Molecular Weight:
147.1772
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Product Description
Catalog Number:
AG009RZP
Chemical Name:
Propionitrile, 3-(3-pyridylamino)- (6CI)
CAS Number:
101257-92-5
Molecular Formula:
C8H9N3
Molecular Weight:
147.1772
MDL Number:
MFCD19220976
IUPAC Name:
3-(pyridin-3-ylamino)propanenitrile
InChI:
InChI=1S/C8H9N3/c9-4-2-6-11-8-3-1-5-10-7-8/h1,3,5,7,11H,2,6H2
InChI Key:
BUMNKYJITTZEJV-UHFFFAOYSA-N
SMILES:
N#CCCNc1cccnc1
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.08g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
147.181g/mol
Monoisotopic Mass:
147.08g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
48.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties