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1608-48-6 | Benzene, 1,2-diiodo-3-methyl-
CAS No: 1608-48-6 Catalog No: AG001VCX MDL No:
Product Description
Catalog Number:
AG001VCX
Chemical Name:
Benzene, 1,2-diiodo-3-methyl-
CAS Number:
1608-48-6
Molecular Formula:
C7H6I2
Molecular Weight:
343.9315
IUPAC Name:
1,2-diiodo-3-methylbenzene
InChI:
InChI=1S/C7H6I2/c1-5-3-2-4-6(8)7(5)9/h2-4H,1H3
InChI Key:
PFLNKRGFZQUABS-UHFFFAOYSA-N
SMILES:
Ic1c(C)cccc1I
Properties
Complexity:
92.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
343.856g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
343.934g/mol
Monoisotopic Mass:
343.856g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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