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Home > Bromides > 1227597-58-1
1227597-58-1 | 2(1H)-Pyridinone, 5-bromo-6-fluoro-
CAS No: 1227597-58-1 Catalog No: AG000JE6 MDL No:MFCD16609912
Product Description
Catalog Number:
AG000JE6
Chemical Name:
2(1H)-Pyridinone, 5-bromo-6-fluoro-
CAS Number:
1227597-58-1
Molecular Formula:
C5H3BrFNO
Molecular Weight:
191.9858
MDL Number:
MFCD16609912
IUPAC Name:
5-bromo-6-fluoro-1H-pyridin-2-one
InChI:
InChI=1S/C5H3BrFNO/c6-3-1-2-4(9)8-5(3)7/h1-2H,(H,8,9)
InChI Key:
JPOAKTBLMUSMSP-UHFFFAOYSA-N
SMILES:
Fc1c(Br)ccc(=O)[nH]1
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.938g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.987g/mol
Monoisotopic Mass:
190.938g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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