1-propenyl propyl sulfide
1-propene, 1-(propylthio)-
 
Notes:
Volatile constit. of Welsh onion, scallions, leek, garlic and shallots. Usually present as a mixt. of (E)- and (Z)-isomers
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      01-21500 ALLYL PROPYL SULFIDE
       
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      Product(s):
      Allyl propyl sulfide
       
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CAS Number: 33922-70-2Picture of molecule3D/inchi
Nikkaji Web: J362.842F
XlogP3-AA: 2.50 (est)
Molecular Weight: 116.22664000
Formula: C6 H12 S
NMR Predictor: Predict (works with chrome or firefox)
Category: flavoring agents
 
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 152.00 to  154.00 °C. @ 760.00 mm Hg
Vapor Pressure: 4.449000 mmHg @ 25.00 °C. (est)
Flash Point: 100.00 °F. TCC ( 37.78 °C. )
logP (o/w): 3.425 (est)
Soluble in:
 water, 299.4 mg/L @ 25 °C (est)
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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:
DeLong Chemicals America
Allyl propyl sulfide, Kosher
Penta International
ALLYL PROPYL SULFIDE
WholeChem
Allyl propyl sulfide
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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 1-propenyl propyl sulfide usage levels up to:
 not for fragrance use.
 
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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 : 10011879
National Institute of Allergy and Infectious Diseases: Data
 1-propylsulfanylprop-1-ene
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References:
 1-propylsulfanylprop-1-ene
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 10011879
Pubchem (sid): 44103977
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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
HMDB (The Human Metabolome Database): HMDB40244
FooDB: FDB019959
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 garlic
Search Trop  Picture
 leek
Search Trop  Picture
 onion
Search Trop  Picture
 scallion
Search Trop  Picture
 shallot
Search Trop  Picture
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Synonyms:
1-propene, 1-(propylthio)-
1-(propyl thio) propene
1-(propyl thio)-1-propene
1-propylsulfanylprop-1-ene
4-thia-2-heptene
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