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828250-20-0 | Benzene, 1,1'-[(1-iodopentylidene)bis(sulfonyl)]bis-
CAS No: 828250-20-0 Catalog No: AG00568X MDL No:
Product Description
Catalog Number:
AG00568X
Chemical Name:
Benzene, 1,1'-[(1-iodopentylidene)bis(sulfonyl)]bis-
CAS Number:
828250-20-0
Molecular Formula:
C17H19IO4S2
Molecular Weight:
478.3648
IUPAC Name:
[1-(benzenesulfonyl)-1-iodopentyl]sulfonylbenzene
InChI:
InChI=1S/C17H19IO4S2/c1-2-3-14-17(18,23(19,20)15-10-6-4-7-11-15)24(21,22)16-12-8-5-9-13-16/h4-13H,2-3,14H2,1H3
InChI Key:
OCNOTUAKYYLCIE-UHFFFAOYSA-N
SMILES:
CCCCC(S(=O)(=O)c1ccccc1)(S(=O)(=O)c1ccccc1)I
Properties
Complexity:
542
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
477.977g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
478.359g/mol
Monoisotopic Mass:
477.977g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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