Home Nitriles 6-Acetylpicolinonitrile

6-Acetylpicolinonitrile

CAS No.:
159307-02-5
Catalog Number:
AG001QLR
Molecular Formula:
C8H6N2O
Molecular Weight:
146.1460
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Product Description
Catalog Number:
AG001QLR
Chemical Name:
6-Acetylpicolinonitrile
CAS Number:
159307-02-5
Molecular Formula:
C8H6N2O
Molecular Weight:
146.1460
MDL Number:
MFCD09263905
IUPAC Name:
6-acetylpyridine-2-carbonitrile
InChI:
InChI=1S/C8H6N2O/c1-6(11)8-4-2-3-7(5-9)10-8/h2-4H,1H3
InChI Key:
LECIQDJPKUDAHR-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(n1)C(=O)C
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.048g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.149g/mol
Monoisotopic Mass:
146.048g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties