methyl propenyl disulfide
methyl 1-propenyl disulfide
 
Notes:
None found
  • BOC Sciences
    • BOC Sciences
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      Product(s):
      5905-47-5 Methyl prop-1-enyl disulfide
       
  • CSA
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    Flavor Demo Formulas
CAS Number: 5905-47-5Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 227-605-4
FDA UNII: Search
CoE Number: 11712
XlogP3-AA: 1.60 (est)
Molecular Weight: 120.23776000
Formula: C4 H8 S2
NMR Predictor: Predict (works with chrome, Edge or firefox)
EFSA/JECFA Comments: At least 90%; secondary components 4-5% methyl 1-dipropyl disulfide and 2-4% propenyl disulfide. (JECFA)
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
Perfumer and Flavorist: Search
Google Patents: Search
US Patents: Search
EU Patents: Search
Pubchem Patents: Search
PubMed: Search
NCBI: Search
JECFA Food Flavoring: 569  methyl 1-propenyl disulfide
DG SANTE Food Flavourings: 12.075  methyl prop-1-enyl disulfide
FEMA Number: 3576 methyl 1-propenyl disulfide
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):5905-47-5 ; METHYL PROPENYL DISULFIDE
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 90.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.95500 to 0.96100 @  25.00 °C.
Pounds per Gallon - (est).: 7.947 to  7.996
Refractive Index: 1.54200 to 1.55200 @  20.00 °C.
Boiling Point: 53.00 to  58.00 °C. @ 14.00 mm Hg
Vapor Pressure: 7.766000 mmHg @ 25.00 °C. (est)
Flash Point: 106.00 °F. TCC ( 41.11 °C. )
logP (o/w): 3.020 (est)
Soluble in:
 water, 556.9 mg/L @ 25 °C (est)
Similar Items: note
allyl methyl disulfide
amyl methyl disulfide
benzyl methyl disulfide
diphenyl methyl disulfide
ethyl methyl disulfide
methyl phenyl methyl disulfide
2-methyl-3-furyl methyl disulfide
2-methyl-3-furyl methyl thiomethyl disulfide
isopentyl methyl disulfide
phenyl methyl disulfide
propyl methyl disulfide
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Axsyn
For experimental / research use only.
Methyldithio-1-propene
BOC Sciences
For experimental / research use only.
Methyl prop-1-enyl disulfide
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the CSA
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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
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Safety in Use Information:
Category: flavoring agents
Recommendation for methyl propenyl disulfide usage levels up to:
 not for fragrance use.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): ND (μg/capita/day)
Structure Class: I
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: 11
Click here to view publication 11
 average usual ppmaverage maximum ppm
baked goods: -1.00000
beverages(nonalcoholic): -1.00000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -1.00000
fruit ices: --
gelatins / puddings: -1.00000
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: -1.00000
soups: --
sugar substitutes: --
sweet sauces: --
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Safety References:
European Food Safety Athority(EFSA): Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
European Food Safety Authority (EFSA) reference(s):
Flavouring Group Evaluation 8 (FGE.08)[1]: Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical group 20
View page or View pdf
Flavouring Group Evaluation 8, Revision 1 (FGE.08Rev1): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 8, Revision 3 (FGE.08Rev3): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 08, Revision 4 (FGE.08Rev4): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30
View page or View pdf
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 : 521863
National Institute of Allergy and Infectious Diseases: Data
 1-(methyldisulfanyl)prop-1-ene
Chemidplus: 0005905475
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References:
 1-(methyldisulfanyl)prop-1-ene
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 5905-47-5
Pubchem (cid): 521863
Pubchem (sid): 135263705
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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
FooDB: FDB021324
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
FAO: Methyl 1-propenyl disulfide
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Potential Blenders and core components note
 
For Odor
alliaceous
 dimethyl trisulfideFL/FR
 dipropyl disulfideFL/FR
 ferula assa-foetida gum oilFL/FR
 propyl mercaptanFL/FR
citrus
 grapefruit mercaptanFL/FR
coffee
 coffee difuranFL/FR
creamy
2,3-butane diolFR
ethereal
2-methyl-1-butanolFL/FR
meaty
 meaty dithianeFL/FR
 dimethyl disulfideFL/FR
 dimethyl sulfideFL/FR
 ferula assa-foetida absoluteFL/FR
 methyl 3-(methyl thio) propionateFL/FR
2-methyl 5-(methyl thio) furanFL/FR
3-(methyl thio) hexanolFL/FR
 onion oilFL/FR
 
For Flavor
 
No flavor group found for these
 allyl methyl disulfideFL
 allyl methyl trisulfideFL
 allyl propyl disulfideFL
 allyl propyl sulfideFL
 allyl propyl trisulfideFL
isoamyl mercaptanFL
 diethyl trisulfideFL
(Z+E)-2,5-dimethyl-3-tetrahydrofuran thiolFL
(Z+E)-2,5-dimethyl-3-thioacetoxytetrahydrofuranFL
 dipropyl sulfideFL
 ethyl methyl trisulfideFL
 ethyl propyl disulfideFL
 ethyl propyl trisulfideFL
 heptyl mercaptanFL
2-(methyl thio) methyl-2-butenalFL
 propenyl propyl disulfideFL
isopropyl disulfideFL
2,3,5-trithiahexaneFL
alliaceous
 allyl disulfideFL
 allyl mercaptanFL
 allyl thiopropionateFL
 benzyl mercaptanFL
1,3-butane dithiolFL
 cyclopentyl mercaptanFL
 dicyclohexyl disulfideFL
 diethyl disulfideFL
 dimethyl trisulfideFL/FR
 dipropyl disulfideFL/FR
 dipropyl trisulfideFL
 ferula assa-foetida gum oilFL/FR
3-mercapto-2-methyl pentanolFL
3-mercapto-2-pentanoneFL
 methyl 3-mercaptobutanoateFL
2-methyl thioacetaldehydeFL
 propyl mercaptanFL/FR
cabbage
 methyl 2-thiofuroateFL
citrus
 grapefruit mercaptanFL/FR
coffee
 coffee difuranFL/FR
corn chip
2-acetyl-2-thiazolineFL
eggy
isopropyl mercaptanFL
ethereal
2-methyl-1-butanolFL/FR
garlic
 allyl methyl sulfideFL
 garlic oleoresinFL
meaty
 meaty dithianeFL/FR
(R,S)-2-mercapto-3-butanolFL
bis(2-methyl-3-furyl) disulfideFL
ortho-thiocresolFL
metallic
3-(methyl thio) hexanolFL/FR
musty
2-methyl 5-(methyl thio) furanFL/FR
onion
 methionolFL
 methyl propyl disulfideFL
 methyl propyl trisulfideFL
 propyl thioacetateFL
roasted
 ethyl 3-(furfuryl thio) propionateFL
seafood
1,4-dithianeFL
sulfurous
 allyl sulfideFL
 butyl mercaptanFL
 diallyl polysulfidesFL
 diallyl tetrasulfideFL
 diallyl trisulfideFL
 dimethyl disulfideFL/FR
 dimethyl sulfideFL/FR
S-ethyl thioacetateFL
 ferula assa-foetida absoluteFL/FR
 furfuryl methyl sulfideFL
 furfuryl thiopropionateFL
3-mercapto-2-methyl pentanalFL
 methyl 2-(methyl thio) butyrateFL
 methyl 2-methyl-3-furyl disulfideFL
 methyl thiomethyl butyrateFL
 onion oilFL/FR
 onion oleoresinFL
vegetable
 methyl 3-(methyl thio) propionateFL/FR
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 garlic bulb
Search Trop  Picture
 leek
Search Trop  Picture
 onion
Search Trop  Picture
 shallot
Search Trop  Picture
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Synonyms:
 disulfide, methyl 1-propenyl
 methyl 1-propenyl disulfide
 methyl dithio-1-propene
 methyl prop-1-enyl disulfide
1-(methyldisulfanyl)-1-propene
1-(methyldisulfanyl)prop-1-ene
1-methyldisulfanylprop-1-ene
 methylpropenyldisulfide
1-propenyl methyl disulfide
1-propenylmethyldisulfide
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