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86186-27-8 | Ethene, triiodonitro-
CAS No: 86186-27-8 Catalog No: AG004K67 MDL No:
Product Description
Catalog Number:
AG004K67
Chemical Name:
Ethene, triiodonitro-
CAS Number:
86186-27-8
Molecular Formula:
C2I3NO2
Molecular Weight:
450.7403
IUPAC Name:
1,1,2-triiodo-2-nitroethene
InChI:
InChI=1S/C2I3NO2/c3-1(4)2(5)6(7)8
InChI Key:
FOINFBWFWNIDNJ-UHFFFAOYSA-N
SMILES:
IC(=C(I)I)[N+](=O)[O-]
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
450.706g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
450.74g/mol
Monoisotopic Mass:
450.706g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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