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diisoamyl trisulfide
3-methyl-1-(3-methylbutyltrisulfanyl)butane

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CAS Number: 955371-64-9Picture of molecule3D/inchi
FDA UNII: 3U69NSA96G
Nikkaji Web:J3.153.039C
XlogP3-AA:4.70 (est)
Molecular Weight:238.48034000
Formula:C10 H22 S3
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:flavoring agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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NCBI:Search
JECFA Food Flavoring:1934 diisoamyl trisulfide
FEMA Number:4580 diisoamyl trisulfide
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):955371-64-9 ; DIISOAMYL TRISULFIDE
 
Physical Properties:
Appearance:colorless to yellow clear liquid (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.98500 to 0.99100 @ 20.00 °C.
Pounds per Gallon - (est).: 8.206 to 8.256
Refractive Index:1.51800 to 1.52400 @ 20.00 °C.
Boiling Point: 89.00 to 91.00 °C. @ 1.00 mm Hg
Soluble in:
 water, 0.4054 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor Description:sulfurous garlic
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Parchem
diisoamyl trisulfide
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association
 
Safety Information:
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
flavoring agents
Recommendation for diisoamyl trisulfide usage levels up to:
 not for fragrance use.
 
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 24
Click here to view publication 24
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: --
cheese: 0.010000.05000
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: --
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: 0.010000.05000
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: 0.001000.01000
soft candy: --
soups: 0.010000.05000
sugar substitutes: --
sweet sauces: --
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :15667721
National Institute of Allergy and Infectious Diseases:Data
3-methyl-1-(3-methylbutyltrisulfanyl)butane
Chemidplus:0955371649
 
References:
 3-methyl-1-(3-methylbutyltrisulfanyl)butane
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):15667721
Pubchem (sid):163643010
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
FDA Substances Added to Food (formerly EAFUS):View
HMDB (The Human Metabolome Database):Search
FAO:Diisoamyl trisulfide
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
bis(3-methyl butyl) trisulfane
3-methyl-1-(3-methylbutyltrisulfanyl)butane
bis(3-methylbutyl)trisulfane
 trisulfide, bis(3-methylbutyl)
 
 
Notes:
None found
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