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144580-17-6 | Benzene, 1-bromo-5-fluoro-2-iodo-3-nitro-
CAS No: 144580-17-6 Catalog No: AG001JS7 MDL No:MFCD22543884
Product Description
Catalog Number:
AG001JS7
Chemical Name:
Benzene, 1-bromo-5-fluoro-2-iodo-3-nitro-
CAS Number:
144580-17-6
Molecular Formula:
C6H2BrFINO2
Molecular Weight:
345.8925
MDL Number:
MFCD22543884
IUPAC Name:
1-bromo-5-fluoro-2-iodo-3-nitrobenzene
InChI:
InChI=1S/C6H2BrFINO2/c7-4-1-3(8)2-5(6(4)9)10(11)12/h1-2H
InChI Key:
FCTQLTWMQHZGJK-UHFFFAOYSA-N
SMILES:
Fc1cc(Br)c(c(c1)[N+](=O)[O-])I
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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