Cas no 24768-43-2 (1-(propylsulfanyl)hexane)
1-(propylsulfanyl)hexane structure
Product Name:1-(propylsulfanyl)hexane
1-(propylsulfanyl)hexane Chemical and Physical Properties
Names and Identifiers
-
- 1-(propylsulfanyl)hexane
- 1-propylsulfanylhexane
- 4-Thiadecane
- Hexane, 1-(propylthio)-
- 24768-43-2
- ABZLKKGJOVPBBL-UHFFFAOYSA-N
- hexyl propyl sulfide
- DTXSID40294986
- NSC99113
- SCHEMBL387424
- NSC-99113
-
- Inchi： 1S/C9H20S/c1-3-5-6-7-9-10-8-4-2/h3-9H2,1-2H3
- InChI Key： ABZLKKGJOVPBBL-UHFFFAOYSA-N
- SMILES： S(CCC)CCCCCC
Computed Properties
- Exact Mass: 160.1287
- Monoisotopic Mass: 160.12857181g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 7
- Complexity: 52.7
- 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: 4.1
- Topological Polar Surface Area: 25.3?2
Experimental Properties
- PSA: 0
1-(propylsulfanyl)hexane Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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