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3-(Methylthio)hexyl acetate

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3-(Methylthio)hexyl acetate manufacturers
3-(Methylthio)hexyl acetate Basic information
Product Name:3-(Methylthio)hexyl acetate
Synonyms:(METHYLTHIO)HEXYL ACETATE;3-(METHYLTHIO)HEXYL ACETATE;3-(METHYLTHIO)HEX-1-YL ACETATE;3-METHYLTHIO-1-HEXYL ACETATE;1-HEXANOL, 3-(METHYLTHIO)-, ACETATE;3-(Methylsulfanyl)hexyl acetate;lychee mercaptan acetate;acetic acid 3-(methylthio)hexyl ester
CAS:51755-85-2
MF:C9H18O2S
MW:190.3
EINECS:
Product Categories:Alphabetical Listings;Flavors and Fragrances;M-N;sulfide Flavor
Mol File:51755-85-2.mol
3-(Methylthio)hexyl acetate Structure
3-(Methylthio)hexyl acetate Chemical Properties
Boiling point 216 °C
density 0.982
refractive index 1.4640
FEMA 3789 | 3-(METHYLTHIO)HEXYL ACETATE
Fp 76 °C
Odorat 0.10 % in dipropylene glycol. sulfury green spicy vegetable tropical
Odor Typesulfurous
biological sourcesynthetic
JECFA Number481
Major Applicationflavors and fragrances
InChIInChI=1S/C9H18O2S/c1-4-5-9(12-3)6-7-11-8(2)10/h9H,4-7H2,1-3H3
InChIKeyVIQXICKUKPVFRK-UHFFFAOYSA-N
SMILESC(OC(=O)C)CC(SC)CCC
LogP2.71
NIST Chemistry Reference3-(Methylthio)hexyl acetate(51755-85-2)
Safety Information
Hazard Codes Xi
Risk Statements 38
Safety Statements 26-36
RIDADR UN 3334
WGK Germany 3
Storage Class10 - Combustible liquids
Hazard ClassificationsSkin Irrit. 2
MSDS Information
3-(Methylthio)hexyl acetate Usage And Synthesis
OccurrenceReported found in yellow passion fruit
Usesflavors and fragrances
DefinitionChEBI: (S)-3-Methylthiohexyl acetate is a carboxylic ester.
Aroma threshold valuesAroma characteristics at 1.0%: sulfurous, green, spicy, pungent and vegetative with a tropical nuance.
Taste threshold valuesTaste characteristics: sulfurous, tropical, biting, vegetative and fruity
3-(Methylthio)hexyl acetate Preparation Products And Raw materials
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