Cas no 41600-37-7 (1,2-Benzisothiazol-3(2H)-one,2,2'-(1,2-ethanediyl)bis-, 1,1,1',1'-tetraoxide)
41600-37-7 structure
Product Name:1,2-Benzisothiazol-3(2H)-one,2,2'-(1,2-ethanediyl)bis-, 1,1,1',1'-tetraoxide
CAS No:41600-37-7
MF:C16H12N2O6S2
MW:392.406281471252
CID:334340
PubChem ID:287562
Update Time:2025-04-19
1,2-Benzisothiazol-3(2H)-one,2,2'-(1,2-ethanediyl)bis-, 1,1,1',1'-tetraoxide Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Benzisothiazol-3(2H)-one,2,2'-(1,2-ethanediyl)bis-, 1,1,1',1'-tetraoxide
- 2-(5-thiophen-2-yltetrazol-1-yl)acetic acid
- 1,1,1',1'-Tetramethyl-4,4'-aethandiyl-bis-piperazinium, Dijodid
- 1,1,1',1'-tetramethyl-4,4'-ethanediyl-bis-piperazinium, diiodide
- 1,2-Bis-(4-methylpiperazino)-ethan-bis-iodmethylat-(4,4')
- 116 HC
- 4,4'-Ethylenebis(1,1-dimethylpiperazinium iodide)
- 4-[2-(4,4-dimethylpiperazin-4-ium-1-yl)ethyl]-1,1-dimethylpiperazin-1
- AC1MIAY7
- Aethylendisaccharin
- LS-113744
- SD 211-02
- 2,2'-(Ethane-1,2-diyl)di(1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione)
- Z18754641
- AKOS007948302
- DTXSID70961836
- NSC147616
- 41600-37-7
- NSC-147616
- 1,1-dioxo-2-[2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl]-1,2-benzothiazol-3-one
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- Inchi: 1S/C16H12N2O6S2/c19-15-11-5-1-3-7-13(11)25(21,22)17(15)9-10-18-16(20)12-6-2-4-8-14(12)26(18,23)24/h1-8H,9-10H2
- InChI Key: YZOXPYCXFAOPLW-UHFFFAOYSA-N
- SMILES: S1(C2C=CC=CC=2C(N1CCN1C(C2C=CC=CC=2S1(=O)=O)=O)=O)(=O)=O
Computed Properties
- Exact Mass: 210.02128
- Monoisotopic Mass: 392.013678
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 26
- Rotatable Bond Count: 3
- Complexity: 756
- 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
- Topological Polar Surface Area: 126
- XLogP3: 0.9
Experimental Properties
- Density: 1.642
- Boiling Point: 663°Cat760mmHg
- Flash Point: 354.8°C
- Refractive Index: 1.692
- PSA: 80.9
- LogP: 2.71320
1,2-Benzisothiazol-3(2H)-one,2,2'-(1,2-ethanediyl)bis-, 1,1,1',1'-tetraoxide Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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