Cas no 68641-72-5 (Benzenesulfonamide,4,4'-[1,2-ethanediylbis(oxy)]bis[N-methyl- (9CI))
68641-72-5 structure
Product Name:Benzenesulfonamide,4,4'-[1,2-ethanediylbis(oxy)]bis[N-methyl- (9CI)
CAS No:68641-72-5
MF:C16H20N2O6S2
MW:400.469801902771
CID:519833
PubChem ID:233518
Update Time:2025-04-19
Benzenesulfonamide,4,4'-[1,2-ethanediylbis(oxy)]bis[N-methyl- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Benzenesulfonamide,4,4'-[1,2-ethanediylbis(oxy)]bis[N-methyl- (9CI)
- DTXSID10988325
- 4,4'-[Ethane-1,2-diylbis(oxy)]bis(N-methylbenzene-1-sulfonamide)
- NSC32090
- NSC-32090
- 68641-72-5
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- Inchi: 1S/C16H20N2O6S2/c1-17-25(19,20)15-7-3-13(4-8-15)23-11-12-24-14-5-9-16(10-6-14)26(21,22)18-2/h3-10,17-18H,11-12H2,1-2H3
- InChI Key: NXLDNIRJEDXUFI-UHFFFAOYSA-N
- SMILES: S(C1C=CC(=CC=1)OCCOC1C=CC(=CC=1)S(NC)(=O)=O)(NC)(=O)=O
Computed Properties
- Exact Mass: 400.07627871g/mol
- Monoisotopic Mass: 400.07627871g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 26
- Rotatable Bond Count: 9
- Complexity: 554
- 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
- XLogP3: 1.5
- Topological Polar Surface Area: 128?2
Benzenesulfonamide,4,4'-[1,2-ethanediylbis(oxy)]bis[N-methyl- (9CI) Related Literature
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Congyu Li,Wenfu Wang,Haiyan Wang,Guokai Yan,Weiyang Dong,Zhaosheng Chu,Huan Wang,Yang Chang RSC Adv., 2021,11, 26721-26731
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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