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16488-60-1 | Thiophene, 2,5-diiodo-3-methyl-
CAS No: 16488-60-1 Catalog No: AG001V3O MDL No:
Product Description
Catalog Number:
AG001V3O
Chemical Name:
Thiophene, 2,5-diiodo-3-methyl-
CAS Number:
16488-60-1
Molecular Formula:
C5H4I2S
Molecular Weight:
349.9592
IUPAC Name:
2,5-diiodo-3-methylthiophene
InChI:
InChI=1S/C5H4I2S/c1-3-2-4(6)8-5(3)7/h2H,1H3
InChI Key:
ZWSORUIBRDJUJO-UHFFFAOYSA-N
SMILES:
Ic1sc(c(c1)C)I
Properties
Complexity:
86.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.812g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
349.956g/mol
Monoisotopic Mass:
349.812g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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