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Home > Bromides > 1226808-77-0
1226808-77-0 | Benzene, 1-bromo-2-fluoro-4-iodo-5-nitro-
CAS No: 1226808-77-0 Catalog No: AG0017MW MDL No:MFCD16295088
Product Description
Catalog Number:
AG0017MW
Chemical Name:
Benzene, 1-bromo-2-fluoro-4-iodo-5-nitro-
CAS Number:
1226808-77-0
Molecular Formula:
C6H2BrFINO2
Molecular Weight:
345.8925
MDL Number:
MFCD16295088
IUPAC Name:
1-bromo-2-fluoro-4-iodo-5-nitrobenzene
InChI:
InChI=1S/C6H2BrFINO2/c7-3-1-6(10(11)12)5(9)2-4(3)8/h1-2H
InChI Key:
BNZPOZOFBGRDLL-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(Br)c(cc1I)F
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.83g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
345.894g/mol
Monoisotopic Mass:
344.83g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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