Triacontanoic acid, methyl ester


Chemical Name: Triacontanoic acid, methyl ester
CAS Number: 629-83-4
Product Number: AG003S0W(AGN-PC-0JKAKL)
Synonyms:
MDL No:
Molecular Formula: C31H62O2
Molecular Weight: 466.8228

Identification/Properties


Properties
Form:
Liquid
Computed Properties
Molecular Weight:
466.835g/mol
XLogP3:
15.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
29
Exact Mass:
466.475g/mol
Monoisotopic Mass:
466.475g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
33
Formal Charge:
0
Complexity:
366
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



Methyl triacontanoate, a long-chain fatty acid methyl ester, plays a crucial role in chemical synthesis as a versatile building block in various industrial processes. This compound is commonly used as a precursor in the production of surfactants, lubricants, and emollients due to its unique chemical properties. In chemical synthesis, methyl triacontanoate can undergo esterification reactions to form derivatives with tailored functionalities, making it a valuable component in the creation of customized compounds for specific applications. Its ability to modify the surface properties of materials also makes it a useful additive in cosmetics, pharmaceuticals, and coatings. Additionally, in organic synthesis, methyl triacontanoate can serve as a starting material for the preparation of other complex molecules, enabling the synthesis of diverse chemical products with varying structures and properties.