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22183-12-6 | 1-(2-iodo-2-phenyl-ethenyl)sulfonyl-4-methyl-benzene
CAS No: 22183-12-6 Catalog No: AG007P8J MDL No:
Product Description
Catalog Number:
AG007P8J
Chemical Name:
1-(2-iodo-2-phenyl-ethenyl)sulfonyl-4-methyl-benzene
CAS Number:
22183-12-6
Molecular Formula:
C15H13IO2S
Molecular Weight:
384.2320
IUPAC Name:
1-[(E)-2-iodo-2-phenylethenyl]sulfonyl-4-methylbenzene
InChI:
InChI=1S/C15H13IO2S/c1-12-7-9-14(10-8-12)19(17,18)11-15(16)13-5-3-2-4-6-13/h2-11H,1H3/b15-11+
InChI Key:
SLHLHCRKKIAGCZ-RVDMUPIBSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)C=C(c1ccccc1)I
NSC Number:
196530
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
383.968g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
384.231g/mol
Monoisotopic Mass:
383.968g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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