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CAS 1019012-13-5

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Methyl 5-formyl-1-phenyl-1H-pyrazole-4-carboxylate

Description:
Methyl 5-formyl-1-phenyl-1H-pyrazole-4-carboxylate is a chemical compound characterized by its pyrazole core, which is a five-membered ring containing two nitrogen atoms. This compound features a formyl group (-CHO) and a carboxylate ester (-COOCH3) substituent, contributing to its reactivity and potential applications in organic synthesis. The presence of the phenyl group enhances its aromatic properties, which can influence its solubility and interaction with other molecules. Typically, compounds like this may exhibit biological activity, making them of interest in medicinal chemistry. The molecular structure suggests potential for various chemical reactions, including nucleophilic substitutions and condensation reactions. Its CAS number, 1019012-13-5, allows for precise identification in chemical databases, facilitating research and application in various fields such as pharmaceuticals, agrochemicals, and materials science. Overall, this compound's unique structural features position it as a valuable entity for further exploration in synthetic and applied chemistry.
Formula:C12H10N2O3
InChI:InChI=1S/C12H10N2O3/c1-17-12(16)10-7-13-14(11(10)8-15)9-5-3-2-4-6-9/h2-8H,1H3
InChI key:InChIKey=BOKKBTDWLJHRAX-UHFFFAOYSA-N
SMILES:C(=O)C=1N(N=CC1C(OC)=O)C2=CC=CC=C2
Synonyms:
  • 1H-Pyrazole-4-carboxylic acid, 5-formyl-1-phenyl-, methyl ester
  • Methyl 5-formyl-1-phenyl-1H-pyrazole-4-carboxylate
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