Benzaldehyde, 4-(3-chlorophenoxy)-


Chemical Name: Benzaldehyde, 4-(3-chlorophenoxy)-
CAS Number: 164522-90-1
Product Number: AG003K0Z(AGN-PC-0NBKFJ)
Synonyms:
MDL No:
Molecular Formula: C13H9ClO2
Molecular Weight: 232.6624

Identification/Properties


Computed Properties
Molecular Weight:
232.663g/mol
XLogP3:
4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
232.029g/mol
Monoisotopic Mass:
232.029g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
224
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:
Danger
UN#:
3077
Hazard Statements:
H302-H319-H334
Precautionary Statements:
P261-P305+P351+P338-P342+P311
Class:
9
Packing Group:

NMR Spectrum


Other Analytical Data


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Chemical Structure



4-(3-Chlorophenoxy)benzaldehyde, a versatile building block in chemical synthesis, plays a crucial role in various industrial and research applications. Its unique molecular structure makes it an ideal reagent for the synthesis of complex organic compounds. As a key intermediate in the production of pharmaceuticals, agrochemicals, and fine chemicals, this compound serves as a valuable tool for chemists and researchers alike. With its aromatic benzaldehyde backbone and chlorophenoxy side chain, 4-(3-Chlorophenoxy)benzaldehyde exhibits diverse reactivity and compatibility with a wide range of functional groups, allowing for the formation of intricate chemical structures with high precision and efficiency. In the realm of organic synthesis, this compound is particularly valued for its ability to undergo various transformations, such as condensation reactions, nucleophilic substitutions, and cross-coupling reactions, enabling the creation of new molecules with tailored properties and functionalities. Whether used as a key ingredient in the development of novel drugs, pesticides, or specialty chemicals, 4-(3-Chlorophenoxy)benzaldehyde remains an indispensable component in the toolbox of synthetic chemists, driving innovation and discovery in the field of organic chemistry.