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23590-00-3 | 2-Pyridinecarboxamide, 3-cyano-
CAS No: 23590-00-3 Catalog No: AG002NT8 MDL No:
Product Description
Catalog Number:
AG002NT8
Chemical Name:
2-Pyridinecarboxamide, 3-cyano-
CAS Number:
23590-00-3
Molecular Formula:
C7H5N3O
Molecular Weight:
147.1341
IUPAC Name:
3-cyanopyridine-2-carboxamide
InChI:
InChI=1S/C7H5N3O/c8-4-5-2-1-3-10-6(5)7(9)11/h1-3H,(H2,9,11)
InChI Key:
PFKPTCLDFSITFB-UHFFFAOYSA-N
SMILES:
N#Cc1cccnc1C(=O)N
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.043g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
147.137g/mol
Monoisotopic Mass:
147.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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