acetyl tributyl citrate
tributyl acetylcitrate
 
Notes:
Flavouring ingredient. Plasticiser used in packaging films for food [DFC]
  • Penta International
    • Penta International Corporation
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      For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes.
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      Product(s):
      01-10900 ACETYL TRIBUTYL CITRATE , Kosher
      01-10905 ACETYL TRIBUTYL CITRATE NF USP, Kosher
       
  • Sigma-Aldrich
    • Sigma-Aldrich
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      The perfect blend of products and services that bring your creativity to life.
      Sigma-Aldrich is a leading Life Science and High Technology company dedicated to providing high-quality, safe and certified flavor ingredients with transparent and easily accessible documentation to customers around the globe. Sigma-Aldrich also provides a suite of analytical tools that allow food analysts to simplify sample preparation, cleanup and analysis steps, while increasing sensitivity to trace ingredients and harmful substances to meet regulations and quality standards.
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      Certified Food Grade Products
      Product(s):
      W308005 Tributyl 2-acetylcitrate, ≥98%, FG
      SDS
       
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tributyl 2-acetyloxypropane-1,2,3-tricarboxylate (Click)
CAS Number: 77-90-7Picture of molecule
Other: 37070-91-0
ECHA EINECS - REACH Pre-Reg: 201-067-0
FDA UNII: 0ZBX0N59RZ
Nikkaji Web: J47.372C
Beilstein Number: 2303316
MDL: MFCD00043554
XlogP3-AA: 3.30 (est)
Molecular Weight: 402.48458000
Formula: C20 H34 O8
BioActivity Summary: listing
NMR Predictor: Predict (works with chrome or firefox)
Category: flavor and fragrance 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
IBM Patents: Obtain
Pubchem Patents: Search
PubMed: Search
NCBI: Search
JECFA Food Flavoring: 630  tributyl acetylcitrate
Flavis Number: 09.511 (Old)
DG SANTE Food Flavourings: 09.511  tributyl acetylcitrate
DG SANTE Food Contact Materials: tributyl acetylcitrate
FEMA Number: 3080  tributyl acetylcitrate
FDA Mainterm: TRIBUTYL ACETYLCITRATE
FDA Regulation:
FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION
Subpart F--Flavoring Agents and Related Substances
Sec. 172.515 Synthetic flavoring substances and adjuvants.


FDA PART 175 -- INDIRECT FOOD ADDITIVES: ADHESIVES AND COMPONENTS OF COATINGS
Subpart B--Substances for Use Only as Components of Adhesives
Sec. 175.105 Adhesives.


FDA PART 175 -- INDIRECT FOOD ADDITIVES: ADHESIVES AND COMPONENTS OF COATINGS
Subpart C--Substances for Use as Components of Coatings
Sec. 175.300 Resinous and polymeric coatings.


FDA PART 175 -- INDIRECT FOOD ADDITIVES: ADHESIVES AND COMPONENTS OF COATINGS
Subpart C--Substances for Use as Components of Coatings
Sec. 175.320 Resinous and polymeric coatings for polyolefin films.


FDA PART 178 -- INDIRECT FOOD ADDITIVES: ADJUVANTS, PRODUCTION AIDS, AND SANITIZERS
Subpart D--Certain Adjuvants and Production Aids
Sec. 178.3910 Surface lubricants used in the manufacture of metallic articles.


FDA PART 181 -- PRIOR-SANCTIONED FOOD INGREDIENTS
Subpart B--Specific Prior-Sanctioned Food Ingredients
Sec. 181.27 Plasticizers.
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Physical Properties:
Appearance: colorless clear oily liquid (est)
Assay: 98.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 1.05000 @  25.00 °C.
Refractive Index: 1.44300 @  20.00 °C.
Melting Point: -76.00 to  -75.00 °C. @ 760.00 mm Hg
Boiling Point: 172.00 to  173.00 °C. @ 1.00 mm Hg
Vapor Pressure: 0.800000 mm/Hg @ 170.00 °C.
Vapor Density: 14.1 ( Air = 1 )
Flash Point: > 230.00 °F. TCC ( > 110.00 °C. )
logP (o/w): 5.227 (est)
Soluble in:
 alcohol
 oils
 water, 0.6464 mg/L @ 25 °C (est)
 water, 5 mg/L @ C (exp)
Insoluble in:
 water
Similar Items: note
acetyl triethyl citrate
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Organoleptic Properties:
Odor Type: herbal
Odor Strength: low
 herbal  winey  sweet  
Odor Description:
at 100.00 %. 
very faint herbal wine sweet
Luebke, William tgsc, (1993)
Substantivity: 204 Hour(s)
  
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: masking agents
perfuming agents
plasticisers
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Suppliers:
Allan Chemical
Acetyl Tributyl Citrate
Covalent Chemical
Acetyl Tributyl Citrate
Jungbunzlauer Suisse
CITROFOL® BII
Parchem
acetyl tributyl citrate
Penta International
ACETYL TRIBUTYL CITRATE , Kosher
Penta International
ACETYL TRIBUTYL CITRATE NF USP, Kosher
Sigma-Aldrich
Tributyl 2-acetylcitrate, ≥98%, FG
Odor: herbaceous; wine-like; sweet
Certified Food Grade Products
TCI AMERICA
For experimental / research use only.
Tributyl O-Acetylcitrate >97.0%(GC)
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Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
None - None found.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
 
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:
gavage-rat LD50  > 30000 mg/kg
Value represents the maximum dose level tested. Animals dosed at 30,000 mg/kg had 100% survival rate.
(Finkelstein & Gold, 1959)

intraperitoneal-mouse LD50  > 4000 mg/kg
Journal of Pharmaceutical Sciences. Vol. 53, Pg. 774, 1964.

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for acetyl tributyl citrate usage levels up to:
  15.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): ND (μg/capita/day)
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: 3
Click here to view publication 3
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): -0.40000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
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: --
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):
Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) on a request from the Commission related to - Flavouring Group Evaluation 10: Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 - (Commission Regulation (EC) No 1565/2000 of 18 July 2000)
View page or View pdf
Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to a 10th list of substances for food contact materials
View page or View pdf
Flavouring Group Evaluation 10, Revision 1 (FGE10 Rev1)[1] - Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food (AFC)
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 10, Revision 2 (FGE.10Rev2): Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30
View page or View pdf
EPI System: View
NLM Hazardous Substances Data Bank: Search
Chemical Carcinogenesis Research Information System: Search
Toxicology Citations: Search
Env. Mutagen Info. Center: Search
EPA Substance Registry Services (TSCA): 77-90-7
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 6505
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 tributyl 2-acetyloxypropane-1,2,3-tricarboxylate
Chemidplus: 0000077907
RTECS: TZ8330000 for cas# 77-90-7
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References:
 tributyl 2-acetyloxypropane-1,2,3-tricarboxylate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 77-90-7
Pubchem (cid): 6505
Pubchem (sid): 134972804
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Other Information:
(IUPAC): Atomic Weights of the Elements 2009
(IUPAC): Atomic Weights of the Elements 2009 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
FDA Everything Added to Food in the United States (EAFUS): View
CHEMBL: View
HMDB (The Human Metabolome Database): HMDB34159
FooDB: FDB012444
Export Tariff Code: 2918.15.5000
Haz-Map: View
Household Products: Search
ChemSpider: View
Wikipedia: View
RSC Learn Chemistry: View
Read: Under the conditions of intended use - New developments in the FEMA GRAS program and the safety assessment of flavor ingredients
Read: A GRAS assessment program for flavor ingredients
Read: Sensory testing for flavorings with modifying properties. Food Technology
Read: Criteria for the safety evaluation of flavoring substances
Read: A procedure for the safety evaluation of natural flavor complexes used as ingredients in food: essential oils
Read: FEMA Expert Panel: 30 Years of safety evaluation for the flavor industry
Read: Consumption ratio and food predominance of flavoring materials
FAO: Tributyl acetylcitrate
Formulations/Preparations:
grades: technical
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
 film formers 
 herbalFR
 plasticisers 
 solvents 
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
2-acetoxy-1,2,3-propane tricarboxylic acid tributyl ester
2-acetoxy-1,2,3-propanetricarboxylic acid tributyl ester
 acetyl citric acid tributyl ester
2-(acetyl oxy)-1,2,3-propane tricarboxylic acid tributyl ester
2-acetyl tributyl citrate
 acetyl tributyl citrate NF USP
 acetyl tributylcitrate
 acetylcitric acid, tributyl ester
2-(acetyloxy)-1,2,3-propanetricarboxylic acid, tributyl ester
 acetyltributyl citrate
 blo-trol
 caswell no. 005ab
 citric acid tributyl ester acetate
 citric acid, O-acetyl-, tributyl ester
 citric acid, tributyl ester, acetate
 citroflex A 4
 citroflex A-4
 dibutyl 3-acetyloxy-3-(butoxycarbonyl)pentane-1,5-dioate
1,2,3-propanetricarboxylic acid, 2- (acetyloxy)-, tributyl ester
1,2,3-propanetricarboxylic acid, 2-(acetyloxy)-, tributyl ester
 TEC
 tributyl 2-(acetyl oxy)-1,2,3-propane tricarboxylate
 tributyl 2-(acetyloxy)-1,2, 3-propanetricarboxylic acid
 tributyl 2-(acetyloxy)-1,2,3-propanetricarboxylate
 tributyl 2-(acetyloxy)propane-1,2,3-tricarboxylate
 tributyl 2-acetoxy-1,2, 3-propanetricarboxylate
 tributyl 2-acetoxy-1,2,3-propane tricarboxylate
 tributyl 2-acetoxy-1,2,3-propanetricarboxylate
 tributyl 2-acetoxypropane-1,2,3-tricarboxylate
 tributyl 2-acetylcitrate
1,2,3-tributyl 2-acetyloxypropane-1,2,3-tricarboxylate
 tributyl acetyl citrate
 tributyl acetylcitrate
 tributyl citrate acetate
 tributyl O-acetyl citrate
 tributyl O-acetylcitrate
 uniplex 84
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