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20018-08-0 | Benzene, [(diiodomethyl)sulfonyl]-
CAS No: 20018-08-0 Catalog No: AG002CLI MDL No:
Product Description
Catalog Number:
AG002CLI
Chemical Name:
Benzene, [(diiodomethyl)sulfonyl]-
CAS Number:
20018-08-0
Molecular Formula:
C7H6I2O2S
Molecular Weight:
407.9953
IUPAC Name:
diiodomethylsulfonylbenzene
InChI:
InChI=1S/C7H6I2O2S/c8-7(9)12(10,11)6-4-2-1-3-5-6/h1-5,7H
InChI Key:
XPQBPGDCDTYGHL-UHFFFAOYSA-N
SMILES:
IC(S(=O)(=O)c1ccccc1)I
NSC Number:
194625
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
407.818g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
407.992g/mol
Monoisotopic Mass:
407.818g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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