Cas no 26158-99-6 (Pentane, 1-(ethylthio)-)
Pentane, 1-(ethylthio)- structure
Product Name:Pentane, 1-(ethylthio)-
CAS No:26158-99-6
MF:C7H16S
MW:132.266941070557
CID:1425528
PubChem ID:520245
Update Time:2025-04-20
Pentane, 1-(ethylthio)- Chemical and Physical Properties
Names and Identifiers
-
- Pentane, 1-(ethylthio)-
- SOGIWVXLDPPMMF-UHFFFAOYSA-N
- n-Pentyl ethyl sulfide
- 24487-57-8
- 1-(Ethylsulfanyl)pentane
- 3-Thiaoctane
- n-Amyl ethyl sulfide
- AKOS006228075
- Sulfide, ethyl pentyl
- DTXSID20334293
- 26158-99-6
- ethyl(pentyl)sulfane
- Ethyl pentyl sulfide
- DB-046467
- Pentyl ethyl sulfide
- SCHEMBL201544
- 1-ethylsulfanylpentane
- n-Pentyl ethyl sulphide
-
- Inchi： 1S/C7H16S/c1-3-5-6-7-8-4-2/h3-7H2,1-2H3
- InChI Key： SOGIWVXLDPPMMF-UHFFFAOYSA-N
- SMILES： S(CC)CCCCC
Computed Properties
- Exact Mass: 132.09738
- Monoisotopic Mass: 132.097
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 8
- Rotatable Bond Count: 5
- Complexity: 35.4
- 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: 3
- Topological Polar Surface Area: 25.3?2
Experimental Properties
- Density: 0.8390
- Melting Point: -66.8°C (estimate)
- Boiling Point: 154.25°C (estimate)
- Refractive Index: 1.4333 (estimate)
- PSA: 0
Pentane, 1-(ethylthio)- Related Literature
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
-
Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
-
Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
-
Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
-
Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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