Octadecanoic acid, 2-ethylhexyl ester


Chemical Name: Octadecanoic acid, 2-ethylhexyl ester
CAS Number: 22047-49-0
Product Number: AG003A1M(AGN-PC-00L26C)
Synonyms:
MDL No:
Molecular Formula: C26H52O2
Molecular Weight: 396.6899

Identification/Properties


Computed Properties
Molecular Weight:
396.7g/mol
XLogP3:
11.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
23
Exact Mass:
396.397g/mol
Monoisotopic Mass:
396.397g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
314
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Ethylhexyl Stearate, a compound commonly used in chemical synthesis, serves as a versatile intermediate in various reactions due to its unique structural properties. As a ester derivative of stearic acid, this chemical plays a crucial role in organic synthesis, particularly in the production of cosmetics, plastics, lubricants, and pharmaceuticals. Its low melting point and high compatibility with a wide range of organic solvents make it a valuable ingredient in the formulation of personal care products such as lotions, creams, and sunscreens. Furthermore, 2-Ethylhexyl Stearate acts as an effective plasticizer in polymer production, enhancing flexibility and durability. In pharmaceutical applications, it serves as a solubilizer and emollient, aiding in the dispersion of active ingredients and providing a smooth texture to topical formulations. Additionally, its chemical stability and inert nature make it a preferred choice in industrial processes requiring controlled reactivity and consistency. Overall, 2-Ethylhexyl Stearate's diverse applications in chemical synthesis highlight its importance as a key ingredient across multiple industries.