Cas no 1680-28-0 (Decanethioic acid, S-ethyl ester)
1680-28-0 structure
Product Name:Decanethioic acid, S-ethyl ester
CAS No:1680-28-0
MF:C12H24OS
MW:216.383362770081
CID:1349173
PubChem ID:13198668
Update Time:2025-04-20
Decanethioic acid, S-ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Decanethioic acid, S-ethyl ester
- S-ethyl decanethioate
- 1680-28-0
- DTXSID60526731
-
- Inchi： 1S/C12H24OS/c1-3-5-6-7-8-9-10-11-12(13)14-4-2/h3-11H2,1-2H3
- InChI Key： JZXOJHUXGUSCNC-UHFFFAOYSA-N
- SMILES： S(CC)C(CCCCCCCCC)=O
Computed Properties
- Exact Mass: 216.15492
- Monoisotopic Mass: 216.15478656g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 10
- Complexity: 134
- 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: 5.1
- Topological Polar Surface Area: 42.4?2
Experimental Properties
- PSA: 17.07
Decanethioic acid, S-ethyl ester Related Literature
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Jason Wan Lab Chip, 2020,20, 4528-4538
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
1680-28-0 (Decanethioic acid, S-ethyl ester) Related Products
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