Cas no 65259-97-4 (5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-2-thione, 6,7-dihydro-)
65259-97-4 structure
Product Name:5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-2-thione, 6,7-dihydro-
5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-2-thione, 6,7-dihydro- Chemical and Physical Properties
Names and Identifiers
-
- 5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-2-thione, 6,7-dihydro-
- 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepine-2-thione
- 2,6,8,10-Tetrathiabicyclo[5.3.0]dec-1(7)-en-9-thion
- 4,5-propylenedithio-1,3-dithiole-2-thione
- HMS665K06
- NCGC00338823-01
- SR-01000521440
- ChemDiv1_027682
- DTXSID20351288
- AKOS001743187
- 65259-97-4
- EU-0085165
- ST4041186
- SR-01000521440-1
- 2H,5H,6H,7H-[1,3]DITHIOLO[4,5-B][1,4]DITHIEPINE-2-THIONE
- SCHEMBL15357318
- AB01331269-02
-
- Inchi: 1S/C6H6S5/c7-6-10-4-5(11-6)9-3-1-2-8-4/h1-3H2
- InChI Key: DOEVIAQPIMUTRZ-UHFFFAOYSA-N
- SMILES: S1C2=C(SC(=S)S2)SCCC1
Computed Properties
- Exact Mass: 237.90700
- Monoisotopic Mass: 237.90730606g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 199
- 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: 3.5
- Topological Polar Surface Area: 133?2
Experimental Properties
- PSA: 139.17000
- LogP: 4.12700
5H-1,3-Dithiolo[4,5-b][1,4]dithiepin-2-thione, 6,7-dihydro- Related Literature
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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4. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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