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Home > Pyridines > 101392-31-8
101392-31-8 | 3-Pyridinecarboxamide, N-acetyl-1,2-dihydro-2-oxo-
CAS No: 101392-31-8 Catalog No: AG0004DF MDL No:MFCD24588418
Product Description
Catalog Number:
AG0004DF
Chemical Name:
3-Pyridinecarboxamide, N-acetyl-1,2-dihydro-2-oxo-
CAS Number:
101392-31-8
Molecular Formula:
C8H8N2O3
Molecular Weight:
180.1607
MDL Number:
MFCD24588418
IUPAC Name:
N-acetyl-2-oxo-1H-pyridine-3-carboxamide
InChI:
InChI=1S/C8H8N2O3/c1-5(11)10-8(13)6-3-2-4-9-7(6)12/h2-4H,1H3,(H,9,12)(H,10,11,13)
InChI Key:
KSQOBAULIYDSMW-UHFFFAOYSA-N
SMILES:
CC(=O)NC(=O)c1ccc[nH]c1=O
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.053g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
180.163g/mol
Monoisotopic Mass:
180.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
75.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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