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Home > Fluorides > 1208078-27-6
1208078-27-6 | 3-Iodo-2',6',2,2,2-pentafluoroacetophenone
CAS No: 1208078-27-6 Catalog No: AG01FB68 MDL No:MFCD12922606
Product Description
Catalog Number:
AG01FB68
Chemical Name:
3-Iodo-2',6',2,2,2-pentafluoroacetophenone
CAS Number:
1208078-27-6
Molecular Formula:
C8H2F5IO
Molecular Weight:
335.9974
MDL Number:
MFCD12922606
IUPAC Name:
1-(2,6-difluoro-3-iodophenyl)-2,2,2-trifluoroethanone
InChI:
InChI=1S/C8H2F5IO/c9-3-1-2-4(14)6(10)5(3)7(15)8(11,12)13/h1-2H
InChI Key:
CEQDYJOGGDVQON-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1C(=O)C(F)(F)F)F)I
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.907g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.999g/mol
Monoisotopic Mass:
335.907g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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