Cas no 2080-58-2 (1,3-dithiolan-2-one)
1,3-dithiolan-2-one structure
Product Name:1,3-dithiolan-2-one
1,3-dithiolan-2-one Chemical and Physical Properties
Names and Identifiers
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- 1,3-dithiolan-2-one
- 1,3-Dithiacyclopentane-2-one
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- Inchi： 1S/C3H4OS2/c4-3-5-1-2-6-3/h1-2H2
- InChI Key： ZBEWVJOWXJNDGJ-UHFFFAOYSA-N
- SMILES： S1C(=O)SCC1
Computed Properties
- Exact Mass: 119.97042
- Monoisotopic Mass: 119.97035709g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 6
- Rotatable Bond Count: 0
- Complexity: 63.2
- 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: 1.4
- Topological Polar Surface Area: 67.7?2
Experimental Properties
- PSA: 17.07
1,3-dithiolan-2-one Related Literature
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Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
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2. 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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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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