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

butyraldehyde dibenzyl thioacetal
butanal dibenzyl thioacetal

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CAS Number: 101780-73-8Picture of molecule3D/inchi
FDA UNII: IYH666B70X
XlogP3-AA:5.90 (est)
Molecular Weight:302.50334000
Formula:C18 H22 S2
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:1939 butanal dibenzyl thioacetal
FEMA Number:4589 butanal dibenzyl thioacetal
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):101780-73-8 ; BUTANAL DIBENZYL THIOACETAL
 
Physical Properties:
Appearance:colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.07300 to 1.07900 @ 25.00 °C.
Pounds per Gallon - (est).: 8.928 to 8.978
Refractive Index:1.58500 to 1.59100 @ 25.00 °C.
Boiling Point: 199.00 to 201.00 °C. @ 2.00 mm Hg
Soluble in:
 water, 0.02668 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor Description:pungent fruity
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Parchem
butyraldehyde dibenzyl thioacetal
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 butyraldehyde dibenzyl thioacetal 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: 0.5000010.00000
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: 0.5000010.00000
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: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: 0.100001.00000
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
Laboratory Chemical Safety Summary :71587383
National Institute of Allergy and Infectious Diseases:Data
1-benzylsulfanylbutylsulfanylmethylbenzene
Chemidplus:0101780738
 
References:
 1-benzylsulfanylbutylsulfanylmethylbenzene
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):71587383
Pubchem (sid):163641169
 
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:Butanal dibenzyl thioacetal
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 butanal dibenzyl thioacetal
1,1’-(butane-1,1-diyl bis(sulfanediyl methanediyl)) dibenzene
1,1’-(butane-1,1-diyl bis(sulfanediylmethanediyl))dibenzene
 butyraldehyde, dibenzyl mercaptal
1-benzylsulfanylbutylsulfanylmethylbenzene
 
 
Notes:
None found
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