EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

2,4,5-trithiaoctane
1-(methylthiomethyl)-2-propyldisulfane

Supplier Sponsors

CAS Number: 911212-28-7Picture of molecule3D/inchi
FDA UNII: 05PPL1MUF0
XlogP3-AA:2.60 (est)
Molecular Weight:168.34564000
Formula:C5 H12 S3
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:flavoring agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Google Patents:Search
US Patents:Search
EU Patents:Search
PubMed:Search
NCBI:Search
FEMA Number:4842 2,4,5-trithiaoctane
FDA:No longer provide for the use of these seven synthetic flavoring substances
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Soluble in:
 water, 192.4 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
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 2,4,5-trithiaoctane 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: 28
Click here to view publication 28
 average usual ppmaverage maximum ppm
baked goods: 0.100000.50000
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: 0.010000.05000
cheese: 0.010002.00000
chewing gum: --
condiments / relishes: 0.100002.00000
confectionery froastings: --
egg products: 0.030000.30000
fats / oils: 0.030000.30000
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: 0.100002.00000
hard candy: --
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: 0.100005.00000
milk products: --
nut products: --
other grains: --
poultry: 0.100005.00000
processed fruits: --
processed vegetables: 0.100002.00000
reconstituted vegetables: --
seasonings / flavors: 0.100005.00000
snack foods: 0.100005.00000
soft candy: --
soups: 0.100002.00000
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
National Institute of Allergy and Infectious Diseases:Data
1-(methylsulfanylmethyldisulfanyl)propane
Chemidplus:0911212287
 
References:
 1-(methylsulfanylmethyldisulfanyl)propane
NIST Chemistry WebBook:Search Inchi
Pubchem (sid):385157113
 
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
HMDB (The Human Metabolome Database):Search
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 disulfide, (methylthio)methyl propyl
1-(methylsulfanylmethyldisulfanyl)propane
1-(methylthiomethyl)-2-propyldisulfane
 
 
Notes:
None found
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