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1187165-43-0 | 2-Chloro-5-(3,4,5-trifluorobenzoyl)pyridine
CAS No: 1187165-43-0 Catalog No: AG01FAUJ MDL No:
Product Description
Catalog Number:
AG01FAUJ
Chemical Name:
2-Chloro-5-(3,4,5-trifluorobenzoyl)pyridine
CAS Number:
1187165-43-0
Molecular Formula:
C12H5ClF3NO
Molecular Weight:
271.6224
IUPAC Name:
(6-chloropyridin-3-yl)-(3,4,5-trifluorophenyl)methanone
InChI:
InChI=1S/C12H5ClF3NO/c13-10-2-1-6(5-17-10)12(18)7-3-8(14)11(16)9(15)4-7/h1-5H
InChI Key:
PLINFODENTYIQR-UHFFFAOYSA-N
SMILES:
Clc1ccc(cn1)C(=O)c1cc(F)c(c(c1)F)F
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.001g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.623g/mol
Monoisotopic Mass:
271.001g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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