pyrazinyl methyl methyl sulfide
mixture of 2-methylthio-3-methylpyrazine and 2-methylthio-5-methylpyrazine
 
Notes:
None found
  • BOC Sciences
    • BOC Sciences
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      Product(s):
      59021-03-3 2-Methyl-3-(methylthio)pyrazine
       
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      625SM Mixture of 2-Methylthio-3-Methylpyrazine and 2-Methylthio-5-Methylpyrazine
       
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      Product(s):
      2-Methylthio-3(5)-methylpyrazine
       
Synonyms   Articles   Notes   Search
CAS Number: 59021-03-3Picture of molecule3D/inchi
Nikkaji Web: J113.403E
Beilstein Number: 0774815
XlogP3-AA: 0.30 (est)
Molecular Weight: 140.20876000
Formula: C6 H8 N2 S
NMR Predictor: Predict (works with chrome or firefox)
Also(can) Contains: 2-methyl-3-(methyl thio) pyrazine
 2-methyl-5-(methyl thio) pyrazine
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
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PubMed: Search
NCBI: Search
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 221.00 to  222.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.161000 mmHg @ 25.00 °C. (est)
Flash Point: 190.00 °F. TCC ( 87.60 °C. ) (est)
logP (o/w): 0.153 (est)
Soluble in:
 alcohol
 water, 2.703e+004 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
 
Flavor Type: cabbage
 
 cabbage  
Taste Description:
cabbage
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
BOC Sciences
For experimental / research use only.
2-Methyl-3-(methylthio)pyrazine
Synerzine
Mixture of 2-Methylthio-3-Methylpyrazine and 2-Methylthio-5-Methylpyrazine
WholeChem
2-Methylthio-3(5)-methylpyrazine
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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:
oral-rat LD50  2150 mg/kg
Food and Cosmetics Toxicology. Vol. 13, Pg. 487, 1975.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: flavoring agents
Recommendation for pyrazinyl methyl methyl sulfide usage levels up to:
 not for fragrance use.
 
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Safety References:
Flavor & Extract Manufacturers Association (FEMA) reference(s):
The FEMA GRAS assessment of pyrazine derivatives used as flavor ingredients. View pdf
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 59021-03-3
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 100930
National Institute of Allergy and Infectious Diseases: Data
 2-(methylsulfanylmethyl)pyrazine
Chemidplus: 0059021033
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References:
 2-(methylsulfanylmethyl)pyrazine
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 100930
Pubchem (sid): 135059725
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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): Search
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
 not found in nature
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Synonyms:
2-(methyl sulfanyl methyl) pyrazine
2-(methyl thio) methyl pyrazine
((methyl thio)methyl) pyrazine
2-methyl thiomethyl pyrazine
2-(methyl thiomethyl) pyrazine
2-(methylsulfanylmethyl)pyrazine
2-methylthio-3-methylpyrazine and 2-methylthio-5-methylpyrazine mixture
2-methylthio-5-methylpyrazine and 2-methylthio-3-methylpyrazine mixture
 mixture of 2-methylthio-3-methylpyrazine and 2-methylthio-5-methylpyrazine
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