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2-(((3-(2,3-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl)thio)methyl)pyridine
pyridine, 2-[[[3-(2,3-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]thio]methyl]-

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CAS Number: 902136-79-2Picture of molecule3D/inchi
FDA UNII: 3YP851XX20
Beilstein Number:12742135
XlogP3-AA:2.90 (est)
Molecular Weight:328.39492000
Formula:C16 H16 N4 O2 S
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:flavor enhancers, umami taste enhancer
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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PubMed:Search
NCBI:Search
JECFA Food Flavoring:2235 2-(((3-(2,3-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl)thio)methyl)pyridine
FEMA Number:4798 2-(((3-(2,3-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl)thio)methyl)pyridine
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, 1778 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:
flavor enhancers, umami taste enhancer
Recommendation for 2-(((3-(2,3-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl)thio)methyl)pyridine 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: 27
Click here to view publication 27
 average usual ppmaverage maximum ppm
baked goods: 2.000006.00000
beverages(nonalcoholic): 1.000002.00000
beverages(alcoholic): --
breakfast cereal: 5.0000010.00000
cheese: 2.000006.00000
chewing gum: --
condiments / relishes: 5.0000010.00000
confectionery froastings: --
egg products: 2.000006.00000
fats / oils: 4.000008.00000
fish products: 4.0000010.00000
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: 4.0000010.00000
hard candy: --
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: 4.0000010.00000
milk products: --
nut products: 2.000006.00000
other grains: 2.000006.00000
poultry: 2.000006.00000
processed fruits: --
processed vegetables: 2.000006.00000
reconstituted vegetables: 2.000006.00000
seasonings / flavors: 10.0000020.00000
snack foods: 10.0000020.00000
soft candy: --
soups: 4.000008.00000
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 :57330888
National Institute of Allergy and Infectious Diseases:Data
2-({[3-(2,3-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]sulfanyl}methyl)pyridine
Chemidplus:0902136792
 
References:
 2-({[3-(2,3-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]sulfanyl}methyl)pyridine
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):57330888
Pubchem (cas):902136-79-2
 
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
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
2-(((3-(2,3-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl)thio) methyl) pyridine
2-({[3-(2,3-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]sulfanyl}methyl)pyridine
2-[[[3-(2,3-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]thio]methyl]pyridine
 pyridine, 2-[[[3-(2,3-dimethoxyphenyl)-1H-1,2,4-triazol-5-yl]thio]methyl]-
 
 
Notes:
None found
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