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28797-07-1

28797-07-1 | Cyclohexane, 1,1'-sulfonylbis-

CAS No: 28797-07-1 Catalog No: AG002WJB MDL No:

Product Description

Catalog Number:
AG002WJB
Chemical Name:
Cyclohexane, 1,1'-sulfonylbis-
CAS Number:
28797-07-1
Molecular Formula:
C12H22O2S
Molecular Weight:
230.3669
IUPAC Name:
cyclohexylsulfonylcyclohexane
InChI:
InChI=1S/C12H22O2S/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2
InChI Key:
MZUPWNMULGRONZ-UHFFFAOYSA-N
SMILES:
O=S(=O)(C1CCCCC1)C1CCCCC1

Properties

Complexity:
253  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.134g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.366g/mol
Monoisotopic Mass:
230.134g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

Literature

Title Journal
The regiochemistry of cyclization of alpha-sulfenyl-, alpha-sulfinyl-, and alpha-sulfonyl-5-hexenyl radicals: procedures leading to regioselective syntheses of cyclic sulfones and sulfoxides. The Journal of organic chemistry 20040528

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