S-(2,5-Dimethyl-3-furanyl) ethanethioate
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S-(2,5-Dimethyl-3-furanyl) ethanethioate
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CAS No:
55764-22-2
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Formula:
C8H10O2S
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Chemical Name:
S-(2,5-Dimethyl-3-furanyl) ethanethioate
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Synonyms:
Ethanethioic acid,S-(2,5-dimethyl-3-furanyl) ester;S-(2,5-Dimethyl-3-furanyl) ethanethioate;3-(Acetylthio)-2,5-dimethylfuran;2,5-Dimethyl-3-furanthiol acetate;1-[(2,5-Dimethylfuran-3-yl)sulfanyl]ethan-1-one
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CAS No:
Description
Colourless liquid; Fruity floral aroma
2,5-Dimethyl-3-furanthiol acetate is an aryl sulfide.
S-(2,5-Dimethyl-3-furanyl) ethanethioate Basic Attributes
170.22900
170.23
259-799-1
6FAQ96BE1Q
DTXSID0069046
Characteristics
55.51000
2.53500
1.14g/cm3
47-48 °C @ Press: 0.25 Torr
92.1ºC
1.53
Practically insoluble in water and hexane; Soluble in ether|Soluble (in ethanol)
S-(2,5-Dimethyl-3-furanyl) ethanethioate Use and Manufacturing
Ethanethioic acid, S-(2,5-dimethyl-3-furanyl) ester: ACTIVE
Food additives -> Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT; -> JECFA Functional Classes|Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT;
Computed Properties
Molecular Weight:170.23
XLogP3:2.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:170.04015073
Monoisotopic Mass:170.04015073
Topological Polar Surface Area:55.5
Heavy Atom Count:11
Complexity:158
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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