Cas no 68844-99-5 (1-methyl-3-(propan-2-yl)trisulfane)
68844-99-5 structure
Product Name:1-methyl-3-(propan-2-yl)trisulfane
CAS No:68844-99-5
MF:C4H10S3
MW:154.317197322845
CID:1730399
PubChem ID:111650
Update Time:2025-04-21
1-methyl-3-(propan-2-yl)trisulfane Chemical and Physical Properties
Names and Identifiers
-
- 1-methyl-3-(propan-2-yl)trisulfane
- 1-Isopropyl-3-methyltrisulfane
- 2-methyl-3,4,5-trithiahexane
- Isopropyl methyl trisulfide
- Methyl isopropyl trisulfide
- trisulfane, 1-methyl-3-(1-methylethyl)-
- 2-(methyltrisulfanyl)propane
- Methyl(1-methylethyl) pertrisulfide
- Trisulfide, methyl 1-methylethyl
- 68844-99-5
- DTXSID2071780
-
- Inchi： 1S/C4H10S3/c1-4(2)6-7-5-3/h4H,1-3H3
- InChI Key： ZUJLLBXDHHTMEV-UHFFFAOYSA-N
- SMILES： S(C(C)C)SSC
Computed Properties
- Exact Mass: 153.994
- Monoisotopic Mass: 153.994
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 7
- Rotatable Bond Count: 3
- Complexity: 35.9
- 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: 2.1
- Topological Polar Surface Area: 75.9?2
Experimental Properties
- Density: 1.127
- Boiling Point: 212.7°C at 760 mmHg
- Flash Point: 81.4°C
- Refractive Index: 1.564
1-methyl-3-(propan-2-yl)trisulfane Related Literature
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Xiao Liu,Jun Xu,Yinyun Lv,Wenyu Wu,Weisheng Liu,Yu Tang Dalton Trans., 2013,42, 9840-9846
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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