ChemicalBook--->CAS DataBase List--->77-90-7

77-90-7

77-90-7 Structure

77-90-7 Structure
IdentificationMore
[Name]

Acetyl tributyl citrate
[CAS]

77-90-7
[Synonyms]

ACETYL TRIBUTYL CITRATE
ACETYL TRI-N-BUTYL CITRATE
ATBC
FEMA 3080
O-ACETYLCITRIC ACID TRIBUTYL ESTER
TRIBUTYL 2-ACETOXY-1,2,3-PROPANETRICARBOXYLATE
TRIBUTYL 2-ACETYLCITRATE
TRIBUTYL ACETYLCITRATE
TRIBUTYL O-ACETYLCITRATE
1,2,3-Propanetricarboxylic acid, 2-acetoxy-, tributyl ester
1,2,3-Propanetricarboxylicacid,2-(acetyloxy)-,tributylester
2-(Acetyloxy)-1,2,3-propane tricarboxylic acid, tributyl ester
2,3-propanetricarboxylicacid,2-(acetyloxy)-tributylester
2-Acetoxy-1,2,3-propanetricarboxylic acid tributyl ester
2-acetoxy-1,2,3-propanetricarboxylicacidtributylester
2-acetyltributylcitrate
Acetyl butyl citrate
Acetyl tributyl citrate1,2,3-propanetricarboxylic acid, 2-(acetyloxy)-, tributyl ester
acetylbutylcitrate
Acetylcitric acid, tributyl ester
[EINECS(EC#)]

201-067-0
[Molecular Formula]

C20H34O8
[MDL Number]

MFCD00043554
[Molecular Weight]

402.48
[MOL File]

77-90-7.mol
Chemical PropertiesBack Directory
[Definition]

Aqueous-based pharmaceutical coat- ings.
[Appearance]

clear colorless liquid
[Melting point ]

-59 °C
[Boiling point ]

327 °C
[density ]

1.05 g/mL at 25 °C(lit.)
[vapor pressure ]

0.26 psi ( 20 °C)
[FEMA ]

3080
[refractive index ]

n20/D 1.443(lit.)
[Fp ]

>230 °F
[storage temp. ]

Store below +30°C.
[solubility ]

Not miscible with water, miscible with ethanol (96 per cent) and with methylene chloride.
[form ]

neat
[color ]

Clear Colourless
[Odor]

at 100.00 %. very faint herbal wine sweet
[Odor Type]

herbal
[Water Solubility ]

<0.1 g/100 mL
[FreezingPoint ]

-80℃
[JECFA Number]

630
[BRN ]

2303316
[InChIKey]

QZCLKYGREBVARF-UHFFFAOYSA-N
[LogP]

5.227 (est)
[CAS DataBase Reference]

77-90-7(CAS DataBase Reference)
[NIST Chemistry Reference]

1,2,3-Propanetricarboxylic acid, 2-(acetyloxy)-, tributyl ester(77-90-7)
[EPA Substance Registry System]

77-90-7(EPA Substance)
Safety DataBack Directory
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[RTECS ]

TZ8330000
[HS Code ]

29181500
[Safety Profile]

When heated to decomposition it emits acrid smoke and irritating fumes. ADD750
[Hazardous Substances Data]

77-90-7(Hazardous Substances Data)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

1-Butanol-->Citric acid
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Acetyl tributyl citrate(77-90-7).msds
Hazard InformationBack Directory
[Chemical Properties]

Acetyl tributyl citrate (ATBC) is a colorless, odorless liquid. Its water solubility is less than 0.002 g/100 mL, but it is soluble in organic solvents.
[Chemical Properties]

Acetyltributyl citrate is a clear, odorless, practically colorless, oily liquid.
[Chemical Properties]

clear colorless liquid
[Chemical Properties]

Tributyl acetylcitrate has a very faint, sweet, herbaceous odor. At high levels (e.g., 1000 ppm emulsion in water), it has a mild, fruity, nondescript flavor.
[Uses]

Labelled Tributyl O-Acetylcitrate (T772950). Topical pharmaceutical formulation anesthetic surfactant ester.
[Uses]

plasticizer flavoring agent
[Preparation]

From citric acid via the tributyl ester followed by acetylation.
[Production Methods]

Acetyltributyl citrate is prepared by the esterification of citric acid with butanol followed by acylation with acetic anhydride.
[General Description]

Tributyl 2-acetylcitrate is a hydrophobic biodegradable plasticizer, that is usually synthesized by esterification of citric acid. Pharmaceutically, it is used as an excipient, which is generally applied as a thin film over the tablets or capsules.
Pharmaceutical secondary standards for application in quality control, provide pharma laboratories and manufacturers with a convenient and cost-effective alternative to the preparation of in-house working standards.
[Pharmaceutical Applications]

Acetyltributyl citrate is used to plasticize polymers in formulated pharmaceutical coatings, including capsules, tablets, beads, and granules for taste masking, immediate release, sustained-release and enteric formulations.
[Safety]

and films intended for direct food contact. It is also used in selfadhesive thin films used for topical delivery systems. It is generally regarded as a relatively nontoxic and nonirritating material. However, ingestion of large quantities may be harmful.
LD50 (cat, oral): >50 mL/kg
LD50 (mouse, IP): >4 g/kg
LD50 (rat, oral): >31.5 g/kg
[Carcinogenicity]

The chronic toxicity of ATBC was evaluated in rats fed diets containing 200, 2000, or 20,000 ppm of ATBC for 2 years. There were no treatment- related lesions in any organs examined.
[storage]

Acetyltributyl citrate should be stored in a well-closed container in a cool, dry location at temperatures not exceeding 38℃. When stored in accordance with these conditions, acetyltributyl citrate is a stable product.
[Incompatibilities]

Acetyltributyl citrate is incompatible with strong alkalis and oxidizing materials.
[Regulatory Status]

Included in FDA Inactive Ingredients Database (oral capsules and tablets). Included in nonparenteral medicines licensed in the UK. Approved in the USA for direct food contact in food films.
Spectrum DetailBack Directory
[Spectrum Detail]

Acetyl tributyl citrate(77-90-7)MS
Acetyl tributyl citrate(77-90-7)1HNMR
Acetyl tributyl citrate(77-90-7)13CNMR
Acetyl tributyl citrate(77-90-7)IR1
Acetyl tributyl citrate(77-90-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

77-90-7(sigmaaldrich)
[TCI AMERICA]

Tributyl O-Acetylcitrate,>97.0%(GC)(77-90-7)
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