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884495-47-0 | 2-NITRO-3,4-DIFLUORO-BROMOBENZENE
CAS No: 884495-47-0 Catalog No: AG004HB9 MDL No:MFCD03840797
Product Description
Catalog Number:
AG004HB9
Chemical Name:
2-NITRO-3,4-DIFLUORO-BROMOBENZENE
CAS Number:
884495-47-0
Molecular Formula:
C6H2BrF2NO2
Molecular Weight:
237.9864
MDL Number:
MFCD03840797
IUPAC Name:
1-bromo-3,4-difluoro-2-nitrobenzene
InChI:
InChI=1S/C6H2BrF2NO2/c7-3-1-2-4(8)5(9)6(3)10(11)12/h1-2H
InChI Key:
QYDCWSXHLDNEBD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(Br)ccc(c1F)F
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.924g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.988g/mol
Monoisotopic Mass:
236.924g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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