2,6-dichloro-4-(trifluoromethyl)pyridine-3-carbaldehyde


Chemical Name: 2,6-dichloro-4-(trifluoromethyl)pyridine-3-carbaldehyde
CAS Number: 914636-56-9
Product Number: AG00GSGM(AGN-PC-058COG)
Synonyms:
MDL No:
Molecular Formula: C7H2Cl2F3NO
Molecular Weight: 243.9980896

Identification/Properties


Computed Properties
Molecular Weight:
243.994g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
242.947g/mol
Monoisotopic Mass:
242.947g/mol
Topological Polar Surface Area:
30A^2
Heavy Atom Count:
14
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



In chemical synthesis, 2,6-Dichloro-4-(trifluoromethyl)-3-pyridinecarboxaldehyde serves as a versatile building block with unique properties that make it an essential component for various reactions. Due to its electron-withdrawing halogen groups and the trifluoromethyl substituent, this compound exhibits high reactivity and can participate in a wide range of transformations. One application of 2,6-Dichloro-4-(trifluoromethyl)-3-pyridinecarboxaldehyde is as a key intermediate in the synthesis of pharmaceuticals and agrochemicals. Its structural features enable it to be used in the construction of complex molecules through functional group transformations such as nucleophilic addition, condensation reactions, and cross-coupling reactions. Additionally, the presence of the pyridine ring confers specific reactivity patterns that can be harnessed for selective derivatization.Furthermore, the trifluoromethyl group in this compound enhances its lipophilicity and metabolic stability, making it a useful tool in drug discovery and development. By incorporating 2,6-Dichloro-4-(trifluoromethyl)-3-pyridinecarboxaldehyde into the molecular structure of target compounds, chemists can modulate their physicochemical properties and optimize their biological activities.Overall, the strategic use of 2,6-Dichloro-4-(trifluoromethyl)-3-pyridinecarboxaldehyde in chemical synthesis enables the efficient and selective construction of complex molecules with diverse applications in the fields of drug discovery, materials science, and agrochemical development.