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63059-25-6 | Benzenesulfonic acid, 2-iodo-
CAS No: 63059-25-6 Catalog No: AG00IB5A MDL No:MFCD01860232
Product Description
Catalog Number:
AG00IB5A
Chemical Name:
Benzenesulfonic acid, 2-iodo-
CAS Number:
63059-25-6
Molecular Formula:
C6H5IO3S
Molecular Weight:
284.0716
MDL Number:
MFCD01860232
IUPAC Name:
2-iodobenzenesulfonic acid
InChI:
InChI=1S/C6H5IO3S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H,8,9,10)
InChI Key:
ZJTNYBYLBTVLRD-UHFFFAOYSA-N
SMILES:
Ic1ccccc1S(=O)(=O)O
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.9g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
284.067g/mol
Monoisotopic Mass:
283.9g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Effective oxidation of benzylic and alkane C-H bonds catalyzed by sodium o-iodobenzenesulfonate with Oxone as a terminal oxidant under phase-transfer conditions. | Organic & biomolecular chemistry 20110407 |
| Hypervalent iodine-mediated oxidation of alcohols. | Chemical communications (Cambridge, England) 20090428 |
| 2-Iodoxybenzenesulfonic acid as an extremely active catalyst for the selective oxidation of alcohols to aldehydes, ketones, carboxylic acids, and enones with oxone. | Journal of the American Chemical Society 20090114 |
| Sodium 2-iodo-benzene-sulfonate monohydrate. | Acta crystallographica. Section E, Structure reports online 20081201 |
| Potassium 2-iodo-benzene-sulfonate monohydrate. | Acta crystallographica. Section E, Structure reports online 20080801 |
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