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Home > Fluorides > 1003711-68-9
1003711-68-9 | 2(1H)-Pyridinone, 5-fluoro-4-methyl-3-nitro-
CAS No: 1003711-68-9 Catalog No: AG0001SI MDL No:
Product Description
Catalog Number:
AG0001SI
Chemical Name:
2(1H)-Pyridinone, 5-fluoro-4-methyl-3-nitro-
CAS Number:
1003711-68-9
Molecular Formula:
C6H5FN2O3
Molecular Weight:
172.1139
IUPAC Name:
5-fluoro-4-methyl-3-nitro-1H-pyridin-2-one
InChI:
InChI=1S/C6H5FN2O3/c1-3-4(7)2-8-6(10)5(3)9(11)12/h2H,1H3,(H,8,10)
InChI Key:
GUGQTNXWOQVQPL-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(=O)[nH]cc(c1C)F
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.028g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.115g/mol
Monoisotopic Mass:
172.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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