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920504-08-1 | Benzene, 1,2-diiodo-4-methoxy-5-nitro-
CAS No: 920504-08-1 Catalog No: AG006EDF MDL No:
Product Description
Catalog Number:
AG006EDF
Chemical Name:
Benzene, 1,2-diiodo-4-methoxy-5-nitro-
CAS Number:
920504-08-1
Molecular Formula:
C7H5I2NO3
Molecular Weight:
404.9284
IUPAC Name:
1,2-diiodo-4-methoxy-5-nitrobenzene
InChI:
InChI=1S/C7H5I2NO3/c1-13-7-3-5(9)4(8)2-6(7)10(11)12/h2-3H,1H3
InChI Key:
WOLKERAZKXPFGN-UHFFFAOYSA-N
SMILES:
COc1cc(I)c(cc1[N+](=O)[O-])I
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
404.836g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
404.93g/mol
Monoisotopic Mass:
404.836g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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