Cas no 22158-12-9 (Carbamo(dithioperoxo)thioicacid, diethyl-, methyl ester (9CI))
22158-12-9 structure
Product Name:Carbamo(dithioperoxo)thioicacid, diethyl-, methyl ester (9CI)
CAS No:22158-12-9
MF:C6H13NS3
MW:195.369117498398
CID:282641
PubChem ID:193582
Update Time:2025-04-19
Carbamo(dithioperoxo)thioicacid, diethyl-, methyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Carbamo(dithioperoxo)thioicacid, diethyl-, methyl ester (9CI)
- methylsulfanyl N,N-diethylcarbamodithioate
- CHEMBL4227735
- 1,1'-{[(Methyldisulfanyl)carbonothioyl]azanediyl}diethane
- DTXSID30944807
- Diethyldithiocarbamic acid methanethiol
- SCHEMBL21237564
- Carbamo(dithioperoxo)thioic acid, diethyl-, (S)-
- 22158-12-9
- Dedcmt
-
- Inchi： 1S/C6H13NS3/c1-4-7(5-2)6(8)10-9-3/h4-5H2,1-3H3
- InChI Key： KDSKYZOAVKDCNN-UHFFFAOYSA-N
- SMILES： S(C(N(CC)CC)=S)SC
Computed Properties
- Exact Mass: 195.021
- Monoisotopic Mass: 195.021
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 101
- 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
- Topological Polar Surface Area: 85.9?2
Experimental Properties
- Density: 1.164
- Boiling Point: 258.7°Cat760mmHg
- Flash Point: 110.3°C
- Refractive Index: 1.593
Carbamo(dithioperoxo)thioicacid, diethyl-, methyl ester (9CI) Related Literature
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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