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150698-74-1 | Ethanone, 1-(3-bromo-4-fluorophenyl)-2,2,2-trifluoro-
CAS No: 150698-74-1 Catalog No: AG001MSU MDL No:MFCD08457469
Product Description
Catalog Number:
AG001MSU
Chemical Name:
Ethanone, 1-(3-bromo-4-fluorophenyl)-2,2,2-trifluoro-
CAS Number:
150698-74-1
Molecular Formula:
C8H3BrF4O
Molecular Weight:
271.0064
MDL Number:
MFCD08457469
IUPAC Name:
1-(3-bromo-4-fluorophenyl)-2,2,2-trifluoroethanone
InChI:
InChI=1S/C8H3BrF4O/c9-5-3-4(1-2-6(5)10)7(14)8(11,12)13/h1-3H
InChI Key:
SFVGYPOXYKGQCG-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)c1ccc(c(c1)Br)F
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.93g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.009g/mol
Monoisotopic Mass:
269.93g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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