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1657-34-7 | Butanamide, 3-oxo-N-3-pyridinyl-
CAS No: 1657-34-7 Catalog No: AG001WBJ MDL No:MFCD01102497
Product Description
Catalog Number:
AG001WBJ
Chemical Name:
Butanamide, 3-oxo-N-3-pyridinyl-
CAS Number:
1657-34-7
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
MDL Number:
MFCD01102497
IUPAC Name:
3-oxo-N-pyridin-3-ylbutanamide
InChI:
InChI=1S/C9H10N2O2/c1-7(12)5-9(13)11-8-3-2-4-10-6-8/h2-4,6H,5H2,1H3,(H,11,13)
InChI Key:
FAIPYLBFPQYODX-UHFFFAOYSA-N
SMILES:
O=C(Nc1cccnc1)CC(=O)C
NSC Number:
108434
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.191g/mol
Monoisotopic Mass:
178.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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