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19025-36-6 | Benzene, 1,3,5-triiodo-2,4,6-trimethyl-
CAS No: 19025-36-6 Catalog No: AG002EFT MDL No:MFCD00456993
Product Description
Catalog Number:
AG002EFT
Chemical Name:
Benzene, 1,3,5-triiodo-2,4,6-trimethyl-
CAS Number:
19025-36-6
Molecular Formula:
C9H9I3
Molecular Weight:
497.8812
MDL Number:
MFCD00456993
IUPAC Name:
1,3,5-triiodo-2,4,6-trimethylbenzene
InChI:
InChI=1S/C9H9I3/c1-4-7(10)5(2)9(12)6(3)8(4)11/h1-3H3
InChI Key:
UUMJKZVRNPVQAM-UHFFFAOYSA-N
SMILES:
Cc1c(I)c(C)c(c(c1I)C)I
Properties
Complexity:
113
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
497.784g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
497.884g/mol
Monoisotopic Mass:
497.784g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
Literature
| Title | Journal |
|---|---|
| 8,10-Diiodo-2,6-dioxo-4λ-ioda-3,5-dioxatricyclo-[5.3.1.0]undeca-1(11),7,9-triene-9-carb-oxy-lic acid. | Acta crystallographica. Section E, Structure reports online 20120301 |
| 1,3,5-Triiodo-2,4,6-trimethylbenzene at 293 K. | Acta crystallographica. Section C, Crystal structure communications 20010901 |
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