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sodium 4-(methyl thio)-2-oxobutanoate
sodium 4-(methylthio)-2-oxobutanoate

Supplier Sponsors

Name:sodium 4-(methylsulfanyl)-2-oxobutanoate
CAS Number: 51828-97-8Picture of molecule3D/inchi
FDA UNII: 2EZY36W75U
MDL:MFCD00010511
Molecular Weight:170.16315928
Formula:C5 H7 Na O3 S
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:flavoring agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
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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:501 sodium 4-(methylthio)-2-oxobutanoate
FEMA Number:3881 sodium 4-(methylthio)-2-oxobutanoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
 
Physical Properties:
Appearance:white powder (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: 300.00 °C. @ 760.00 mm Hg
Boiling Point: 483.00 °C. @ 760.00 mm Hg
Flash Point: 32.00 °F. TCC ( 0.00 °C. ) (est)
Shelf Life: 12.00 month(s) or longer if stored properly.
Storage:refrigerate in tightly sealed containers.
Soluble in:
 water, 1e+006 mg/L @ 25 °C (est)
 white petrolatum
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
4-Methylthio-2-oxobutanoic Acid Sodium Salt ≥97%
Parchem
sodium 4-(methyl thio)-2-oxobutanoate
Santa Cruz Biotechnology
For experimental / research use only.
a-Keto-?-(methylthio)butyric acid sodium salt
Sigma-Aldrich: Sigma
For experimental / research use only.
a-Keto-?-(methylthio)butyric acid sodium salt ≥97%
 
Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 36/37/38 - Irritating to eyes, respiratory system, and skin.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
 
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 sodium 4-(methyl thio)-2-oxobutanoate 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: 18
Click here to view publication 18
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: --
cheese: 0.500005.00000
chewing gum: --
condiments / relishes: 0.100005.00000
confectionery froastings: 0.100005.00000
egg products: --
fats / oils: 0.300005.00000
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: --
imitation dairy: --
instant coffee / tea: 0.500005.00000
jams / jellies: --
meat products: 0.500005.00000
milk products: 0.500005.00000
nut products: --
other grains: --
poultry: 0.300005.00000
processed fruits: --
processed vegetables: 0.100005.00000
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: 1.000005.00000
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 :23696623
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 3335
WGK Germany:3
sodium 4-(methylsulfanyl)-2-oxobutanoate
Chemidplus:0051828978
 
References:
 sodium 4-(methylsulfanyl)-2-oxobutanoate
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):23696623
Pubchem (sid):172113398
 
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
Export Tariff Code:2930.90.4550
ChemSpider:View
FAO:Sodium 4-(methylthio)-2-oxobutanoate
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 butanoic acid, 4-(methylthio)-2-oxo-, sodium salt (1:1)
4-methyl thio-2-oxobutyric acid sodium salt
4-(methyl thio)-2-oxobutyric acid sodium salt
4-methylthio-2-oxobutanoic acid sodium salt
4-methylthio-2-oxobutanoic acid, sodium salt
4-methylthio-2-oxobutanoicacidsodiumsalt
4-methylthio-2-oxobutyric acid sodium salt
4-(methylthio)-2-oxobutyric acid sodium salt
a-keto-?-(methylthio)butyric acid sodium salt
 sodium 4-(methylsulfanyl)-2-oxobutanoate
 sodium 4-(methylthio)-2-oxobutanoate
 
 
Notes:
None found
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