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88576-41-4

88576-41-4 | Benzene, 1-(2-butenylsulfonyl)-4-iodo-

CAS No: 88576-41-4 Catalog No: AG008BFJ MDL No:

Product Description

Catalog Number:
AG008BFJ
Chemical Name:
Benzene, 1-(2-butenylsulfonyl)-4-iodo-
CAS Number:
88576-41-4
Molecular Formula:
C10H11IO2S
Molecular Weight:
322.1626
IUPAC Name:
1-but-2-enylsulfonyl-4-iodobenzene
InChI:
InChI=1S/C10H11IO2S/c1-2-3-8-14(12,13)10-6-4-9(11)5-7-10/h2-7H,8H2,1H3
InChI Key:
IYPYLSZZONUDIS-UHFFFAOYSA-N
SMILES:
CC=CCS(=O)(=O)c1ccc(cc1)I

Properties

Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.952g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.16g/mol
Monoisotopic Mass:
321.952g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.7  

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