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1333319-73-5 | Pyridine, 4-[2,4-bis(trifluoromethyl)phenyl]-2-chloro-
CAS No: 1333319-73-5 Catalog No: AG0014O2 MDL No:
Product Description
Catalog Number:
AG0014O2
Chemical Name:
Pyridine, 4-[2,4-bis(trifluoromethyl)phenyl]-2-chloro-
CAS Number:
1333319-73-5
Molecular Formula:
C13H6ClF6N
Molecular Weight:
325.6369
IUPAC Name:
4-[2,4-bis(trifluoromethyl)phenyl]-2-chloropyridine
InChI:
InChI=1S/C13H6ClF6N/c14-11-5-7(3-4-21-11)9-2-1-8(12(15,16)17)6-10(9)13(18,19)20/h1-6H
InChI Key:
SPEVYPUGXRHGPM-UHFFFAOYSA-N
SMILES:
Clc1nccc(c1)c1ccc(cc1C(F)(F)F)C(F)(F)F
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.009g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.638g/mol
Monoisotopic Mass:
325.009g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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