CAS 1258608-59-1
:Methyl 3-(4-amino-3-pyridinyl)benzoate
Description:
Methyl 3-(4-amino-3-pyridinyl)benzoate, identified by its CAS number 1258608-59-1, is an organic compound characterized by its ester functional group and a pyridine ring. This compound features a methyl ester derived from benzoic acid, with a substitution at the meta position by a 4-amino-3-pyridinyl group. The presence of the amino group introduces basicity and potential for hydrogen bonding, which can influence its solubility and reactivity. Methyl 3-(4-amino-3-pyridinyl)benzoate is likely to exhibit moderate polarity due to the combination of the aromatic system and the polar ester and amino functionalities. It may be soluble in organic solvents and exhibit limited solubility in water. This compound could be of interest in medicinal chemistry, particularly in the development of pharmaceuticals, due to the biological activity often associated with pyridine derivatives. Its synthesis and characterization would typically involve standard organic reactions, including esterification and substitution reactions. Safety data and handling precautions should be consulted, as with any chemical substance, to ensure proper laboratory practices.
Formula:C13H12N2O2
InChI:InChI=1S/C13H12N2O2/c1-17-13(16)10-4-2-3-9(7-10)11-8-15-6-5-12(11)14/h2-8H,1H3,(H2,14,15)
InChI key:InChIKey=VXFRLCKLOVCKIJ-UHFFFAOYSA-N
SMILES:NC=1C(C2=CC(C(OC)=O)=CC=C2)=CN=CC1
Synonyms:- Benzoic acid, 3-(4-amino-3-pyridinyl)-, methyl ester
- Methyl 3-(4-amino-3-pyridinyl)benzoate
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