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Home > Fluorides > 1187169-30-7
1187169-30-7 | 5-(2,5-Difluorobenzoyl)-2-methylpyridine
CAS No: 1187169-30-7 Catalog No: AG01FBVI MDL No:
Product Description
Catalog Number:
AG01FBVI
Chemical Name:
5-(2,5-Difluorobenzoyl)-2-methylpyridine
CAS Number:
1187169-30-7
Molecular Formula:
C13H9F2NO
Molecular Weight:
233.2135
IUPAC Name:
(2,5-difluorophenyl)-(6-methylpyridin-3-yl)methanone
InChI:
InChI=1S/C13H9F2NO/c1-8-2-3-9(7-16-8)13(17)11-6-10(14)4-5-12(11)15/h2-7H,1H3
InChI Key:
XFXGZDPYHPQTKX-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)C(=O)c1ccc(nc1)C)F
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.065g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.218g/mol
Monoisotopic Mass:
233.065g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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