CAS 927802-59-3

Methyl 3-amino-4-(cyclopropylmethoxy)benzoate

Description:

Methyl 3-amino-4-(cyclopropylmethoxy)benzoate, identified by its CAS number 927802-59-3, is an organic compound characterized by its benzoate structure, which includes a methyl ester group and an amino group. The presence of the cyclopropylmethoxy substituent introduces unique steric and electronic properties, potentially influencing its reactivity and biological activity. This compound may exhibit moderate solubility in organic solvents due to its hydrophobic cyclopropyl group, while the amino and methoxy functionalities can engage in hydrogen bonding, affecting its solubility in polar solvents. The compound's structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, where the amino group may serve as a site for further functionalization or interaction with biological targets. Additionally, the presence of the cyclopropyl group may enhance the compound's metabolic stability or alter its pharmacokinetic properties. Overall, Methyl 3-amino-4-(cyclopropylmethoxy)benzoate represents a versatile scaffold for further chemical exploration and potential therapeutic applications.

Formula: C₁₂H₁₅NO₃

InChI: InChI=1S/C12H15NO3/c1-15-12(14)9-4-5-11(10(13)6-9)16-7-8-2-3-8/h4-6,8H,2-3,7,13H2,1H3

InChI key: InChIKey=NSJBZYWLAYCFRF-UHFFFAOYSA-N

SMILES: O(CC1CC1)C2=C(N)C=C(C(OC)=O)C=C2

Synonyms:

• Benzoic acid, 3-amino-4-(cyclopropylmethoxy)-, methyl ester
• Methyl 3-amino-4-(cyclopropylmethoxy)benzoate