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Home > Bromides > 1261988-16-2
1261988-16-2 | Benzene, 5-bromo-1,2-difluoro-3-nitro-
CAS No: 1261988-16-2 Catalog No: AG000SAJ MDL No:MFCD18311821
Product Description
Catalog Number:
AG000SAJ
Chemical Name:
Benzene, 5-bromo-1,2-difluoro-3-nitro-
CAS Number:
1261988-16-2
Molecular Formula:
C6H2BrF2NO2
Molecular Weight:
237.9864
MDL Number:
MFCD18311821
IUPAC Name:
5-bromo-1,2-difluoro-3-nitrobenzene
InChI:
InChI=1S/C6H2BrF2NO2/c7-3-1-4(8)6(9)5(2-3)10(11)12/h1-2H
InChI Key:
OUPFVSYTAGACOT-UHFFFAOYSA-N
SMILES:
Brc1cc(F)c(c(c1)[N+](=O)[O-])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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