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Home > Bromides > 1807245-37-9
1807245-37-9 | Ethanone, 2-bromo-1-(4-bromo-3,5-difluorophenyl)-
CAS No: 1807245-37-9 Catalog No: AG0022AB MDL No:
Product Description
Catalog Number:
AG0022AB
Chemical Name:
Ethanone, 2-bromo-1-(4-bromo-3,5-difluorophenyl)-
CAS Number:
1807245-37-9
Molecular Formula:
C8H4Br2F2O
Molecular Weight:
313.9216
IUPAC Name:
2-bromo-1-(4-bromo-3,5-difluorophenyl)ethanone
InChI:
InChI=1S/C8H4Br2F2O/c9-3-7(13)4-1-5(11)8(10)6(12)2-4/h1-2H,3H2
InChI Key:
FZZGDFDIXWGENL-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1cc(F)c(c(c1)F)Br
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.858g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.924g/mol
Monoisotopic Mass:
311.86g/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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