1,2,4-Trithiolane, 3,5-diethyl-
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1,2,4-Trithiolane, 3,5-diethyl-
structure -
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CAS No:
54644-28-9
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Formula:
C6H12S3
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Chemical Name:
1,2,4-Trithiolane, 3,5-diethyl-
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Synonyms:
1,2,4-Trithiolane, 3,5-diethyl-;3,5-DIETHYL-1,2,4-TRITHIOLANE;MIXTURE OF 3,6-DIETHYL-1,2,4,5-TETRATHIANE AND 3,5-DIETHYL-1,2,4-TRITHIOLANE
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CAS No:
Description
(+/-)-cis- and trans-3,5-Diethyl-1,2,4-trithiolane has a characteristic sulfur odor.
Clear, yellow liquid; Powerful, sulfureous aroma
Characteristics
75.9
3.58680
1.111g/cm3
262.3ºC at 760 mmHg
113.7ºC
1.558
Soluble in heptane and triacetin; insoluble in water|Soluble (in ethanol)
1,2,4-Trithiolane, 3,5-diethyl- Use and Manufacturing
Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents
Computed Properties
Molecular Weight:180.4
XLogP3:3.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:180.01011390
Monoisotopic Mass:180.01011390
Topological Polar Surface Area:75.9
Heavy Atom Count:9
Complexity:74.4
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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