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Home > Fluorides > 1187163-80-9
1187163-80-9 | 2-(2,5-Difluorobenzoyl)-4-methylpyridine
CAS No: 1187163-80-9 Catalog No: AG01FBSN MDL No:
Product Description
Catalog Number:
AG01FBSN
Chemical Name:
2-(2,5-Difluorobenzoyl)-4-methylpyridine
CAS Number:
1187163-80-9
Molecular Formula:
C13H9F2NO
Molecular Weight:
233.2135
IUPAC Name:
(2,5-difluorophenyl)-(4-methylpyridin-2-yl)methanone
InChI:
InChI=1S/C13H9F2NO/c1-8-4-5-16-12(6-8)13(17)10-7-9(14)2-3-11(10)15/h2-7H,1H3
InChI Key:
VJVKKKYBWCDICO-UHFFFAOYSA-N
SMILES:
Cc1ccnc(c1)C(=O)c1cc(F)ccc1F
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:
3.1
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