Phosphoric acid, trihexyl ester


Chemical Name: Phosphoric acid, trihexyl ester
CAS Number: 2528-39-4
Product Number: AG003V2N(AGN-PC-0JLPIE)
Synonyms:
MDL No:
Molecular Formula: C18H39O4P
Molecular Weight: 350.4736

Identification/Properties


Properties
BP:
192-193 °C(Press: 6.5 Torr)
Storage:
2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
350.48g/mol
XLogP3:
6.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
18
Exact Mass:
350.259g/mol
Monoisotopic Mass:
350.259g/mol
Topological Polar Surface Area:
44.8A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
241
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



Trihexylphosphate is a versatile chemical compound used in various chemical synthesis processes. It is commonly employed as a solvent, plasticizer, and flame retardant in various industries such as polymers, adhesives, and coatings. In chemical synthesis, Trihexylphosphate serves as an effective catalyst in esterification and transesterification reactions, facilitating the formation of esters and other organic compounds. Its ability to enhance reaction rates and yields makes it a valuable tool in the production of pharmaceuticals, fragrances, and fine chemicals. Additionally, Trihexylphosphate can act as a stabilizer in polymerization reactions, improving the quality and properties of the final polymer products. Its high thermal stability and compatibility with a wide range of chemical substances make it an essential ingredient in the synthesis of advanced materials and specialty chemicals.