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15813-09-9 | 1H-Imidazole, 4,5-diiodo-
CAS No: 15813-09-9 Catalog No: AG001Q0E MDL No:MFCD00963878
Product Description
Catalog Number:
AG001Q0E
Chemical Name:
1H-Imidazole, 4,5-diiodo-
CAS Number:
15813-09-9
Molecular Formula:
C3H2I2N2
Molecular Weight:
319.8703
MDL Number:
MFCD00963878
IUPAC Name:
4,5-diiodo-1H-imidazole
InChI:
InChI=1S/C3H2I2N2/c4-2-3(5)7-1-6-2/h1H,(H,6,7)
InChI Key:
XMWPTVMTXKJONE-UHFFFAOYSA-N
SMILES:
Ic1[nH]cnc1I
Properties
Complexity:
68
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.831g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
319.872g/mol
Monoisotopic Mass:
319.831g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Literature
| Title | Journal |
|---|---|
| 4,5-Diiodo-2-phenyl-1H-imidazole. | Acta crystallographica. Section E, Structure reports online 20120201 |
| Concise total synthesis of naamine G and naamidine H. | Chemical communications (Cambridge, England) 20100328 |
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