[1,1'-Biphenyl]-3-carboxaldehyde


Chemical Name: [1,1'-Biphenyl]-3-carboxaldehyde
CAS Number: 1204-60-0
Product Number: AG007PY2(AGN-PC-0JLN9U)
Synonyms:
MDL No:
Molecular Formula: C13H10O
Molecular Weight: 182.2179

Identification/Properties


Computed Properties
Molecular Weight:
182.222g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
182.073g/mol
Monoisotopic Mass:
182.073g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
182
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#:
N/A
Hazard Statements:
H302-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



[1,1'-Biphenyl]-3-carbaldehyde is a versatile compound that finds wide application in chemical synthesis, particularly in the field of organic chemistry. Its unique structure consisting of a biphenyl ring with a formyl group at the 3-position makes it a valuable building block for the synthesis of various complex molecules.One of the key applications of [1,1'-Biphenyl]-3-carbaldehyde is as a precursor in the synthesis of functionalized biphenyl derivatives. By selectively modifying the formyl group or other positions on the biphenyl ring, chemists can create a diverse range of biphenyl-based compounds with specific properties and functionalities. These derivatives have found use in materials science, pharmaceuticals, and agrochemicals, among other fields.Furthermore, [1,1'-Biphenyl]-3-carbaldehyde can be utilized in the preparation of ligands for coordination chemistry and organometallic complexes. Its ability to chelate metal ions and form stable complexes makes it a valuable tool for designing catalysts and studying metal-ligand interactions in various chemical reactions.In summary, [1,1'-Biphenyl]-3-carbaldehyde plays a crucial role in chemical synthesis by serving as a key intermediate for the construction of diverse organic molecules with tailored properties and applications. Its versatility and reactivity make it a valuable asset in the toolbox of synthetic chemists seeking to access novel compounds for various scientific and industrial purposes.