Benzaldehyde, 6-chloro-2-fluoro-3-methyl-


Chemical Name: Benzaldehyde, 6-chloro-2-fluoro-3-methyl-
CAS Number: 286474-59-7
Product Number: AG002VYY(AGN-PC-0K2UJU)
Synonyms:
MDL No:
Molecular Formula: C8H6ClFO
Molecular Weight: 172.5840

Identification/Properties


Properties
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
172.583g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
172.009g/mol
Monoisotopic Mass:
172.009g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
151
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:
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



6-Chloro-2-fluoro-3-methylbenzaldehyde, also known as $name$, is a valuable compound in chemical synthesis. This versatile aldehyde serves as a key building block in the creation of various pharmaceuticals, agrochemicals, and fine chemicals. In chemical synthesis, 6-Chloro-2-fluoro-3-methylbenzaldehyde is utilized as a starting material for the production of a wide range of organic compounds. Its unique structure and reactivity enable it to participate in a variety of transformations, including nucleophilic substitution reactions, condensation reactions, and aromatic substitutions. The presence of both a chloro and a fluoro group in this compound enhances its utility in medicinal chemistry, where these functional groups can be strategically manipulated to fine-tune the biological activity and physicochemical properties of the resulting molecules. Additionally, the methyl group provides steric hindrance, which can impact the selectivity and efficiency of certain chemical reactions. Overall, 6-Chloro-2-fluoro-3-methylbenzaldehyde plays a crucial role in the synthesis of complex organic molecules with diverse applications in the fields of pharmaceuticals, agrochemicals, and materials science.