| Identification | More | [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 Properties | Back 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.)
| [Pour Point ]
-43 | [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 | [biological source]
synthetic | [Odor Type]
herbal | [Water Solubility ]
<0.1 g/100 mL | [FreezingPoint ]
-80℃ | [JECFA Number]
630 | [BRN ]
2303316 | [Henry's Law Constant]
2.6×104 mol/(m3Pa) at 25℃, HSDB (2015) | [Cosmetics Ingredients Functions]
FRAGRANCE
PERFUMING
PLASTICISER | [Cosmetic Ingredient Review (CIR)]
Acetyl tributyl citrate (77-90-7) | [InChI]
1S/C20H34O8/c1-5-8-11-25-17(22)14-20(28-16(4)21,19(24)27-13-10-7-3)15-18(23)26-12-9-6-2/h5-15H2,1-4H3 | [InChIKey]
QZCLKYGREBVARF-UHFFFAOYSA-N | [SMILES]
CCCCOC(=O)CC(CC(=O)OCCCC)(OC(C)=O)C(=O)OCCCC | [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 Data | Back Directory | [Symbol(GHS) ]
GHS07 | [Signal word ]
Warning | [Hazard statements ]
H302-H315-H319-H335 | [Precautionary statements ]
P261-P301+P312-P302+P352-P304+P340-P305+P351+P338 | [Safety Statements ]
S24/25:Avoid contact with skin and eyes . | [WGK Germany ]
3
| [RTECS ]
TZ8330000
| [TSCA ]
TSCA listed | [REACH Registrations]
Active | [HS Code ]
29181500 | [Storage Class]
10 - Combustible liquids | [Safety Profile]
When heated to decomposition it emits acrid smoke and irritating fumes.
ADD750 | [Hazardous Substances Data]
77-90-7(Hazardous Substances Data) |
| Hazard Information | Back 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. | [Taste threshold values]
An emulsion of the title material in water at 1000 ppm has only a very faint, mildly fruity-winey, berry-like odor and a mild, nondescript taste.
| [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. | [Solubility in organics]
Miscible with alcohol and oils.
| [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. |
|
| Company Name: |
J & K SCIENTIFIC LTD.
|
| Telephone: |
18210857532 18210857532 |
| Website: |
https://www.jkchemical.com |
| Company Name: |
Energy Chemical
|
| Telephone: |
400-0056266 |
| Website: |
www.energy-chemical.com |
| Company Name: |
China Langchem Inc.
|
| Telephone: |
0086-21-58956006 |
| Website: |
www.chemicalbook.com/ShowSupplierProductsList19141/0_EN.htm |
|