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16488-62-3 | Thiophene, 2,3,5-triiodo-4-methyl-
CAS No: 16488-62-3 Catalog No: AG001V3N MDL No:
Product Description
Catalog Number:
AG001V3N
Chemical Name:
Thiophene, 2,3,5-triiodo-4-methyl-
CAS Number:
16488-62-3
Molecular Formula:
C5H3I3S
Molecular Weight:
475.8557
IUPAC Name:
2,3,5-triiodo-4-methylthiophene
InChI:
InChI=1S/C5H3I3S/c1-2-3(6)5(8)9-4(2)7/h1H3
InChI Key:
JIHAFAYYNYZRII-UHFFFAOYSA-N
SMILES:
Ic1sc(c(c1I)C)I
NSC Number:
109391
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
475.709g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
475.852g/mol
Monoisotopic Mass:
475.709g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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