Decanoic acid, 9-oxo-


Chemical Name: Decanoic acid, 9-oxo-
CAS Number: 1422-26-0
Product Number: AG001HYJ(AGN-PC-0JKC1N)
Synonyms:
MDL No:
Molecular Formula: C10H18O3
Molecular Weight: 186.2481

Identification/Properties


Properties
MP:
47.5-48.5 °C
BP:
337.0±25.0 °C(Predicted)
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
186.251g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
8
Exact Mass:
186.126g/mol
Monoisotopic Mass:
186.126g/mol
Topological Polar Surface Area:
54.4A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
164
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



9-Oxodecanoic acid, also known as 9-oxodecanoate or 9-oxocapric acid, is a valuable compound widely used in chemical synthesis applications. This organic acid serves as a versatile building block in the production of various organic compounds due to its unique chemical properties.In chemical synthesis, 9-Oxodecanoic acid can be employed as a precursor in the synthesis of esters, amides, and other derivatives through various chemical reactions. One common application is its use in the preparation of flavors and fragrances, where it can be transformed into esters that contribute to the desired aroma and taste profiles of final products.Furthermore, 9-Oxodecanoic acid can participate in the synthesis of biologically active molecules, pharmaceutical intermediates, and specialty chemicals. Its flexible chemical structure allows for modifications that enable the creation of custom compounds with specific properties and functionalities tailored for various applications.Overall, the use of 9-Oxodecanoic acid in chemical synthesis offers a wide range of possibilities for creating diverse compounds with unique properties, making it a valuable resource for researchers and chemists in various industries.