trans-buchu mercaptan acetate

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(1R,4R)-menthone-8-thioacetate

CAS: 57074-34-7 C12 H20 O2 S MW: 228.35480000

Identification

Nametrans-buchu mercaptan acetate
IUPACS-[2-[(1R,4R)-4-methyl-2-oxocyclohexyl]propan-2-yl] ethanethioate
CAS Number57074-34-7
EINECS260-546-2
FDA UNII1HQV1B71RE
Molecular FormulaC12 H20 O2 S
Molecular Weight228.35480000
Nikkaji NumberJ326.465C

Regulatory

FEMA Number3809
FDANo longer provide for the use of these seven synthetic flavoring substances

Physical Properties

Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Boiling Point 318.00 to 320.00 °C. @ 760.00 mm Hg
Vapor Pressure 0.000317 mmHg @ 25.00 °C. (est)
Flash Point 261.00 °F. TCC ( 127.22 °C. )
logP (o/w) 2.571 (est)
Soluble in alcohol
Insoluble in water

Cosmetic Information

CosIngcosmetic data
Cosmetic Usesperfuming agents

Organoleptic Properties

Odor Description herbal

Safety Information

Oral/Parenteral ToxicityNot determined
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categoryflavor and fragrance agents
RIFM Fragrance Material Safety AssessmentSearch
Recommendation for trans-buchu mercaptan acetate usage levels up to0.5000 % in the fragrance concentrate.
baked goods1.00000
beverages(nonalcoholic)0.10000
beverages(alcoholic)0.20000
breakfast cereal0.50000
cheese0.50000
chewing gum5.00000
condiments / relishes-
confectionery froastings1.00000
egg products-
fats / oils3.00000
fish products-
frozen dairy0.20000
fruit ices0.20000
gelatins / puddings0.50000
granulated sugar-
gravies-
hard candy1.00000
imitation dairy0.20000
instant coffee / tea-
jams / jellies0.50000
meat products-
milk products0.20000
nut products-
other grains-
poultry-
processed fruits-
processed vegetables0.10000
reconstituted vegetables0.10000
seasonings / flavors-
snack foods-
soft candy1.00000
soups-
sugar substitutes-
sweet sauces0.20000

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57074-34-7 S-[2-(4-methyl-2-oxocyclohexyl)propan-2
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Potential Uses

None Found

Natural Occurrence

buchu leaf oil

Synonyms

(1R,4R)- buchu mercaptan acetate (E)- buchu mercaptan acetate ethane thioic acid S-(1-methyl-1-((1R,4R)-4-methyl-2-oxocyclohexyl)ethyl) ester (1theta-trans)- ethane thioic acid S-(1-methyl-1-(4-methyl-2-oxocyclohexyl)ethyl) ester (1R,4R)- menthone-8-thioacetate menthone-8-thioacetate, (1R,4R)- S-(1- methyl-1-(4-methyl-2-oxocyclohexyl) ethyl)-(1R-trans) ethanethioate S-[2-[(1R,4R)-4- methyl-2-oxocyclohexyl]propan-2-yl] ethanethioate Try the PubMed Search.