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Acetyl triethyl citrate

Catalog Number
ACM77894-5
CAS Number
77-89-4
Product Name
Acetyl triethyl citrate
Structure
Category
Plastic Additives
Synonyms
Triethyl O-acetylcitrate
IUPAC Name
Triethyl 2-acetyloxypropane-1,2,3-tricarboxylate
Molecular Weight
318.32
Molecular Formula
C14H22O8
Canonical SMILES
CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)OC(=O)C
InChI
InChI=1S/C14H22O8/c1-5-19-11(16)8-14(22-10(4)15,13(18)21-7-3)9-12(17)20-6-2/h5-9H2,1-4H3
InChI Key
WEAPVABOECTMGR-UHFFFAOYSA-N
Boiling Point
228-229 °C
Melting Point
-42°C
Flash Point
>230 °F
Purity
>97.0%(GC)
Density
1.136 g/mL
Appearance
colorless or light yellow liquid
Application
Acetyl triethyl citrate is a clear, odorless, and practically colorless oily liquid primarily utilized as a plasticizer in various applications. It plays a crucial role in the production of flexible and biodegradable films made from poly(lactic) acid. Additionally, it is extensively used in the formulation of pharmaceutical coatings, enhancing the properties of capsules, tablets, beads, and granules. These coatings serve multiple purposes, including taste masking and facilitating immediate, sustained-release, and enteric drug formulations. Acetyl triethyl citrate is also integral to diffusion-controlled release drug delivery systems, contributing to the effective management of active ingredient release.
Complexity
395
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
EC Number
201-066-5
Exact Mass
318.13146766
Formal Charge
0
Heavy Atom Count
22
Hydrogen Bond Acceptor Count
8
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
318.13146766
Rotatable Bond Count
13
Safety Description
23-24/25
Topological Polar Surface Area
105 Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Viscosity
53.7cp (25°C)
WGK Germany
1
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