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1187165-90-7 | 2-Chloro-5-(pentafluorobenzoyl)pyridine
CAS No: 1187165-90-7 Catalog No: AG01FC73 MDL No:
Product Description
Catalog Number:
AG01FC73
Chemical Name:
2-Chloro-5-(pentafluorobenzoyl)pyridine
CAS Number:
1187165-90-7
Molecular Formula:
C12H3ClF5NO
Molecular Weight:
307.6033
IUPAC Name:
(6-chloropyridin-3-yl)-(2,3,4,5,6-pentafluorophenyl)methanone
InChI:
InChI=1S/C12H3ClF5NO/c13-5-2-1-4(3-19-5)12(20)6-7(14)9(16)11(18)10(17)8(6)15/h1-3H
InChI Key:
IBGJLRNTAAFHOY-UHFFFAOYSA-N
SMILES:
Clc1ccc(cn1)C(=O)c1c(F)c(F)c(c(c1F)F)F
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.982g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.604g/mol
Monoisotopic Mass:
306.982g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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