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89488-57-3 | 1,4-Diiodo-2-nitrobenzene
CAS No: 89488-57-3 Catalog No: AG0041SC MDL No:MFCD09030977
Product Description
Catalog Number:
AG0041SC
Chemical Name:
1,4-Diiodo-2-nitrobenzene
CAS Number:
89488-57-3
Molecular Formula:
C6H3I2NO2
Molecular Weight:
374.9025
MDL Number:
MFCD09030977
IUPAC Name:
1,4-diiodo-2-nitrobenzene
InChI:
InChI=1S/C6H3I2NO2/c7-4-1-2-5(8)6(3-4)9(10)11/h1-3H
InChI Key:
WNAMUUCHNYHBEV-UHFFFAOYSA-N
SMILES:
Ic1ccc(c(c1)[N+](=O)[O-])I
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.825g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
374.904g/mol
Monoisotopic Mass:
374.825g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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