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Home > Bromides > 1208078-23-2
1208078-23-2 | 2',6'-Dibromo-2,2,2-trifluoroacetophenone
CAS No: 1208078-23-2 Catalog No: AG01FBIX MDL No:MFCD12922574
Product Description
Catalog Number:
AG01FBIX
Chemical Name:
2',6'-Dibromo-2,2,2-trifluoroacetophenone
CAS Number:
1208078-23-2
Molecular Formula:
C8H3Br2F3O
Molecular Weight:
331.9120
MDL Number:
MFCD12922574
IUPAC Name:
1-(2,6-dibromophenyl)-2,2,2-trifluoroethanone
InChI:
InChI=1S/C8H3Br2F3O/c9-4-2-1-3-5(10)6(4)7(14)8(11,12)13/h1-3H
InChI Key:
FRZOSCFUJMAIEM-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)c1c(Br)cccc1Br
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.848g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.914g/mol
Monoisotopic Mass:
329.85g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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