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CAS 864182-44-5

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Pentanoic acid, 2-(aminomethyl)-4-methyl-, methyl ester, hydrochloride (1:1)

Description:
Pentanoic acid, 2-(aminomethyl)-4-methyl-, methyl ester, hydrochloride (1:1), with the CAS number 864182-44-5, is a chemical compound characterized by its structure, which includes a pentanoic acid backbone modified with an aminomethyl group and a methyl ester functional group. This compound is typically a white to off-white solid, soluble in water due to the presence of the hydrochloride salt form, which enhances its solubility compared to the free base. It exhibits properties typical of both carboxylic acids and amines, making it potentially useful in various applications, including pharmaceuticals and organic synthesis. The presence of the methyl ester suggests it may participate in esterification reactions, while the amino group can engage in nucleophilic reactions. Additionally, the hydrochloride form indicates that it can act as a proton donor, influencing its reactivity and interaction with other chemical species. Overall, this compound's unique functional groups contribute to its potential utility in medicinal chemistry and related fields.
Formula:C8H17NO2·ClH
InChI:InChI=1S/C8H17NO2.ClH/c1-6(2)4-7(5-9)8(10)11-3;/h6-7H,4-5,9H2,1-3H3;1H
InChI key:InChIKey=XQVGAFLEJSGENN-UHFFFAOYSA-N
SMILES:C(C(OC)=O)(CC(C)C)CN.Cl
Synonyms:
  • Pentanoic acid, 2-(aminomethyl)-4-methyl-, methyl ester, hydrochloride (1:1)
  • Pentanoic acid, 2-(aminomethyl)-4-methyl-, methyl ester, hydrochloride
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