Dodecanoic acid, 12-(4-nitrophenoxy)-


Chemical Name: Dodecanoic acid, 12-(4-nitrophenoxy)-
CAS Number: 230613-81-7
Product Number: AG002M2K(AGN-PC-07HAT2)
Synonyms:
MDL No:
Molecular Formula: C18H27NO5
Molecular Weight: 337.4107

Identification/Properties


Properties
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
337.416g/mol
XLogP3:
6.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
13
Exact Mass:
337.189g/mol
Monoisotopic Mass:
337.189g/mol
Topological Polar Surface Area:
92.4A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
348
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



12-(4-nitrophenoxy)dodecanoic Acid is a valuable compound utilized in chemical synthesis for its unique properties and applications. As a specialized fatty acid derivative, it serves as a key building block in the creation of various complex organic compounds. Its strategic positioning of the nitro and phenoxy groups within the aliphatic chain enables precise control over the reactivity and selectivity in synthetic reactions.In chemical synthesis, 12-(4-nitrophenoxy)dodecanoic Acid plays a crucial role as a versatile intermediate in the preparation of functional materials such as surfactants, liquid crystals, and polymers. With its tailored structure, this compound serves as a molecular scaffold for introducing specific functionalities through selective transformations. The nitro group can undergo reduction or substitution reactions to modulate the chemical behavior of the compound, while the phenoxy group can participate in cross-coupling or aromatic substitution reactions to diversify its chemical properties.Furthermore, the unique combination of hydrophobic and hydrophilic moieties in 12-(4-nitrophenoxy)dodecanoic Acid makes it a valuable component in the design of amphiphilic molecules for applications in emulsion stabilization, drug delivery systems, and biomaterials. By incorporating this compound into synthetic pathways, chemists can tailor the physicochemical properties of the final products to meet specific performance criteria in various industrial applications.Overall, the strategic utilization of 12-(4-nitrophenoxy)dodecanoic Acid in chemical synthesis enables the controlled synthesis of functional molecules with tailored properties, making it an essential tool for the development of advanced materials and pharmaceuticals.