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1391033-20-7 | 3,5-Difluoro-4-(trifluoromethyl)pyridine
CAS No: 1391033-20-7 Catalog No: AG01FC05 MDL No:
Product Description
Catalog Number:
AG01FC05
Chemical Name:
3,5-Difluoro-4-(trifluoromethyl)pyridine
CAS Number:
1391033-20-7
Molecular Formula:
C6H2F5N
Molecular Weight:
183.0788
IUPAC Name:
3,5-difluoro-4-(trifluoromethyl)pyridine
InChI:
InChI=1S/C6H2F5N/c7-3-1-12-2-4(8)5(3)6(9,10)11/h1-2H
InChI Key:
IOKAPTOVFHLDBN-UHFFFAOYSA-N
SMILES:
Fc1cncc(c1C(F)(F)F)F
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.011g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.081g/mol
Monoisotopic Mass:
183.011g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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