CAS 1255099-42-3
:Methyl 3-(cyanomethyl)-2-methoxybenzoate
Description:
Methyl 3-(cyanomethyl)-2-methoxybenzoate, identified by its CAS number 1255099-42-3, is an organic compound characterized by its ester functional group, which is derived from benzoic acid. This compound features a methoxy group (-OCH3) and a cyanomethyl group (-CH2CN) attached to the benzene ring, contributing to its unique chemical properties. The presence of the methoxy group enhances its solubility in organic solvents and may influence its reactivity in various chemical reactions. The cyanomethyl group introduces a nitrile functionality, which can participate in nucleophilic addition reactions and may serve as a precursor for further synthetic transformations. Methyl 3-(cyanomethyl)-2-methoxybenzoate is likely to exhibit moderate to high polarity due to the presence of both the methoxy and cyano groups, affecting its interactions with other molecules. This compound may find applications in organic synthesis, pharmaceuticals, or as an intermediate in the production of more complex chemical entities. As with all chemical substances, proper handling and safety precautions should be observed due to potential toxicity or reactivity.
Formula:C11H11NO3
InChI:InChI=1S/C11H11NO3/c1-14-10-8(6-7-12)4-3-5-9(10)11(13)15-2/h3-5H,6H2,1-2H3
InChI key:InChIKey=MQECMPXMTFYSNV-UHFFFAOYSA-N
SMILES:O(C)C1=C(C(OC)=O)C=CC=C1CC#N
Synonyms:- Benzoic acid, 3-(cyanomethyl)-2-methoxy-, methyl ester
- Methyl 3-(cyanomethyl)-2-methoxybenzoate
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