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844879-35-2 | 3-BROMO-3',4'-DIFLUOROBENZOPHENONE
CAS No: 844879-35-2 Catalog No: AG0054YE MDL No:MFCD06201465
Product Description
Catalog Number:
AG0054YE
Chemical Name:
3-BROMO-3',4'-DIFLUOROBENZOPHENONE
CAS Number:
844879-35-2
Molecular Formula:
C13H7BrF2O
Molecular Weight:
297.0949
MDL Number:
MFCD06201465
IUPAC Name:
(3-bromophenyl)-(3,4-difluorophenyl)methanone
InChI:
InChI=1S/C13H7BrF2O/c14-10-3-1-2-8(6-10)13(17)9-4-5-11(15)12(16)7-9/h1-7H
InChI Key:
MXMRCWGRNCWZIQ-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)C(=O)c1ccc(c(c1)F)F
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.965g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.099g/mol
Monoisotopic Mass:
295.965g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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