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Tributyl citrate

Catalog Number
ACM77941
CAS Number
77-94-1
Product Name
Tributyl citrate
Structure
Category
Plastic Additives; Plasticizers
Synonyms
Tri-n-butyl citrate;Tributyl 2-hydroxy-1,2,3-propanetricarboxylate;1,2,3-Propanetricarboxylic acid, 2-hydroxy-, 1,2,3-tributyl ester;1,2,3-Propanetricarboxylic acid, 2-hydroxy-, tributyl ester;Citric acid, tributyl ester
Description
Liquid
IUPAC Name
Tributyl 2-hydroxypropane-1,2,3-tricarboxylate
Molecular Weight
360.44
Molecular Formula
C18H32O7
Canonical SMILES
CCCCOC(=O)CC(CC(=O)OCCCC)(C(=O)OCCCC)O
InChI
ZFOZVQLOBQUTQQ-UHFFFAOYSA-N
InChI Key
InChI=1S/C18H32O7/c1-4-7-10-23-15(19)13-18(22,17(21)25-12-9-6-3)14-16(20)24-11-8-5-2/h22H,4-14H2,1-3H3
Boiling Point
234 °C 17mmHg
Melting Point
>300 °C(lit.)
Flash Point
300 °C
Purity
99%
Density
1.043g/ml
Appearance
Colorless to Almost colorless clear liquid
Application
Tributyl citrate serves as a versatile plasticizer, primarily employed to enhance the mechanical properties and flexibility of various materials. It is an oily, clear, and odorless liquid that improves the ductility of poly(lactide) polymers and is incorporated into zein films for industrial processing. Additionally, tributyl citrate finds significant application in the pharmaceutical industry, where it is used to plasticize polymers in coatings for capsules, tablets, beads, and granules. These coatings serve diverse purposes, including taste masking and modifying drug release profiles, whether for immediate, sustained, or enteric release formulations.
Assay
0.9999
Complexity
382
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
EC Number
201-071-2
Exact Mass
360.21480336
Formal Charge
0
Heavy Atom Count
25
Hydrogen Bond Acceptor Count
7
Hydrogen Bond Donor Count
1
Isotope Atom Count
0
MDL Number
MFCD00027217
MeSH Entry Terms
citric acid tributyl ester;tributyl citrate;tributyl citric acid
Monoisotopic Mass
360.21480336
NSC Number
8491
Packaging
1 kg
Refractive Index
1.443-1.446
Rotatable Bond Count
17
Stability
Stable under normal temperatures and pressures.
Storage Conditions
Store in a cool, dry place. Keep container closed when not in use.
Topological Polar Surface Area
99.1 Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
UNII
827D5B1B6S
Viscosity
32cp (25°C)
XLogP3
2.7
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