Cas no 26544-02-5 (tert-Hexanethiol(7CI,9CI))
tert-Hexanethiol(7CI,9CI) structure
Product Name:tert-Hexanethiol(7CI,9CI)
tert-Hexanethiol(7CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- tert-Hexanethiol(7CI,9CI)
- tert-Hexanethiol
- EN300-179951
- FT-0691756
- NS00025334
- 2-Methyl-2-pentanethiol
- 1,1-Dimethylbutyl hydrosulfide #
- T-Hexyl Mercaptan
- 26544-02-5
- 1633-97-2
- EINECS 247-771-1
- 2-PENTANETHIOL, 2-METHYL-
- EINECS 216-651-0
- YRZ9KLW85B
- 2-Methylpentane-2-thiol
- UNII-YRZ9KLW85B
- DTXSID00167561
- ISUXQQTXICTKOV-UHFFFAOYSA-N
- AKOS006279127
- SCHEMBL23906
-
- Inchi： 1S/C6H14S/c1-4-5-6(2,3)7/h7H,4-5H2,1-3H3
- InChI Key： ISUXQQTXICTKOV-UHFFFAOYSA-N
- SMILES： SC(C)(C)CCC
Computed Properties
- Exact Mass: 118.08172
- Monoisotopic Mass: 118.08162162g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 7
- Rotatable Bond Count: 2
- Complexity: 48.1
- 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: 2.4
- Topological Polar Surface Area: 1?2
Experimental Properties
- PSA: 0
tert-Hexanethiol(7CI,9CI) Related Literature
-
1. 976. Acid-catalysed addition of thiols to conjugated dienesB. Saville J. Chem. Soc. 1962 5040
-
2. 1186. The reaction of sulphur and sulphur compounds with olefinic substances. Part XIV. The reaction of sulphur and of dibenzyl tetrasulphide with 2-methylpent-2-ene and cis- and trans-3-methylpent-2-eneC. G. Moore,M. Porter J. Chem. Soc. 1965 6390
-
B. Saville Analyst 1961 86 29
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4. The reactions of amines and sulphur with olefins. Part II. The reaction of diethylamine and sulphur with trialkylethylenesC. G. Moore,R. W. Saville J. Chem. Soc. 1954 2089
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