Cas no 74962-30-4 (6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one)
![6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one structure](https://ossimg.kuujia.com/scimg/75000/74962-30-4x500.png)
74962-30-4 structure
Product Name:6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one
CAS No:74962-30-4
MF:C6H6OS4
MW:222.37123632431
CID:2801028
PubChem ID:746242
Update Time:2025-04-21
6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one Chemical and Physical Properties
Names and Identifiers
-
- 6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one
- 4,5-propylenedithio-1,3-dithiol-2-one;
- 74962-30-4
- ST50974614
- DTXSID80353602
- EU-0011327
- SCHEMBL1520342
- AKOS000676023
-
- Inchi： 1S/C6H6OS4/c7-6-10-4-5(11-6)9-3-1-2-8-4/h1-3H2
- InChI Key： PXNCTRSVBUZLSI-UHFFFAOYSA-N
- SMILES： S1C2=C(SC(=O)S2)SCCC1
Computed Properties
- Exact Mass: 221.93000
- Monoisotopic Mass: 221.93014950g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 203
- 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: 2.9
- Topological Polar Surface Area: 118?2
Experimental Properties
- PSA: 124.15000
- LogP: 2.75770
6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
74962-30-4 (6,7-dihydro-5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-one) Related Products
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