Cas no 80223-79-6 (Benzenesulfonylchloride, 2-methoxy-5-(2-oxopropyl)-)
80223-79-6 structure
Product Name:Benzenesulfonylchloride, 2-methoxy-5-(2-oxopropyl)-
CAS No:80223-79-6
MF:C10H11ClO4S
MW:262.709941148758
CID:707644
PubChem ID:13106258
Update Time:2025-04-19
Benzenesulfonylchloride, 2-methoxy-5-(2-oxopropyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonylchloride, 2-methoxy-5-(2-oxopropyl)-
- 2-methoxy-5-(2-oxopropyl)benzenesulfonyl chloride
- 5-ACETONYL-2-METHOXYBENZENESULPHONYLCHLORIDE
- 3-(Chlorosulfonyl)-4-methoxyphenylacetone
- 5-ACETONYL-2-METHOXYBENZENESULFONYLCHLORIDE
- Benzenesulfonylchloride,2-methoxy-5-(2-oxopropyl)
- 3-chlorosulfonyl-4-methoxyphenylactone
- 80223-79-6
- JCEWAIRJQKPKBH-UHFFFAOYSA-N
- 2-Methoxy-5-(2-oxopropyl)benzene-1-sulfonyl chloride
- 3-chlorosulfonyl-4-methoxyphenylacetone
- DTXSID60518292
- SCHEMBL4660848
-
- Inchi： 1S/C10H11ClO4S/c1-7(12)5-8-3-4-9(15-2)10(6-8)16(11,13)14/h3-4,6H,5H2,1-2H3
- InChI Key： JCEWAIRJQKPKBH-UHFFFAOYSA-N
- SMILES： ClS(C1=C(C=CC(=C1)CC(C)=O)OC)(=O)=O
Computed Properties
- Exact Mass: 262.00700
- Monoisotopic Mass: 262.0066577g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 346
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 3
- XLogP3: 1.5
- Topological Polar Surface Area: 68.8?2
Experimental Properties
- PSA: 68.82000
- LogP: 2.83500
Benzenesulfonylchloride, 2-methoxy-5-(2-oxopropyl)- Related Literature
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
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