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211122-40-6 | Pyridine, 5-bromo-2-chloro-3-(trifluoromethyl)-
CAS No: 211122-40-6 Catalog No: AG002L72 MDL No:MFCD11100983
Product Description
Catalog Number:
AG002L72
Chemical Name:
Pyridine, 5-bromo-2-chloro-3-(trifluoromethyl)-
CAS Number:
211122-40-6
Molecular Formula:
C6H2BrClF3N
Molecular Weight:
260.4390
MDL Number:
MFCD11100983
IUPAC Name:
5-bromo-2-chloro-3-(trifluoromethyl)pyridine
InChI:
InChI=1S/C6H2BrClF3N/c7-3-1-4(6(9,10)11)5(8)12-2-3/h1-2H
InChI Key:
KPIJBKHHJXXREK-UHFFFAOYSA-N
SMILES:
Brc1cnc(c(c1)C(F)(F)F)Cl
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.901g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.438g/mol
Monoisotopic Mass:
258.901g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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