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173974-88-4 | Ethanone, 1-(4-bromophenyl)-2,2-difluoro-
CAS No: 173974-88-4 Catalog No: AG001ZBH MDL No:MFCD20921396
Product Description
Catalog Number:
AG001ZBH
Chemical Name:
Ethanone, 1-(4-bromophenyl)-2,2-difluoro-
CAS Number:
173974-88-4
Molecular Formula:
C8H5BrF2O
Molecular Weight:
235.0255
MDL Number:
MFCD20921396
IUPAC Name:
1-(4-bromophenyl)-2,2-difluoroethanone
InChI:
InChI=1S/C8H5BrF2O/c9-6-3-1-5(2-4-6)7(12)8(10)11/h1-4,8H
InChI Key:
AULWQWKDUPKRJT-UHFFFAOYSA-N
SMILES:
FC(C(=O)c1ccc(cc1)Br)F
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.949g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.028g/mol
Monoisotopic Mass:
233.949g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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