Cas no 183134-28-3 (2,3-Dihydroxypropyl 2-sulfanylpropanoate)
183134-28-3 structure
Product Name:2,3-Dihydroxypropyl 2-sulfanylpropanoate
CAS No:183134-28-3
MF:C6H12O4S
MW:180.222081184387
CID:2783600
PubChem ID:22105057
Update Time:2025-04-21
2,3-Dihydroxypropyl 2-sulfanylpropanoate Chemical and Physical Properties
Names and Identifiers
-
- 2,3-Dihydroxypropyl 2-sulfanylpropanoate
- 183134-28-3
- DTXSID60622469
- SCHEMBL8531051
-
- Inchi： 1S/C6H12O4S/c1-4(11)6(9)10-3-5(8)2-7/h4-5,7-8,11H,2-3H2,1H3
- InChI Key： MZCAZOUPSJQYMW-UHFFFAOYSA-N
- SMILES： SC(C)C(=O)OCC(CO)O
Computed Properties
- Exact Mass: 180.04563003Da
- Monoisotopic Mass: 180.04563003Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 128
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.5
- Topological Polar Surface Area: 67.8?2
2,3-Dihydroxypropyl 2-sulfanylpropanoate Related Literature
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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