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CAS 1187930-01-3

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Benzoic acid, 3-[(methylamino)methyl]-, methyl ester, hydrochloride (1:1)

Description:
Benzoic acid, 3-[(methylamino)methyl]-, methyl ester, hydrochloride (1:1) is a chemical compound characterized by its structure, which includes a benzoic acid moiety, a methylamino group, and a methyl ester functional group, along with a hydrochloride salt form. This compound typically appears as a white to off-white crystalline solid and is soluble in water due to the presence of the hydrochloride, which enhances its solubility compared to the free base form. The methylamino group contributes to its potential biological activity, making it of interest in pharmaceutical applications. The compound may exhibit properties such as moderate acidity due to the benzoic acid component and can participate in various chemical reactions typical of esters and amines. Its hydrochloride form indicates that it can exist as a stable salt, which is often preferred for storage and handling in laboratory settings. Safety data should be consulted for handling precautions, as with any chemical substance, to ensure proper safety measures are taken during use.
Formula:C10H13NO2·ClH
InChI:InChI=1S/C10H13NO2.ClH/c1-11-7-8-4-3-5-9(6-8)10(12)13-2;/h3-6,11H,7H2,1-2H3;1H
InChI key:InChIKey=WUBDXFGVYQGRQF-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=CC(CNC)=CC=C1.Cl
Synonyms:
  • Benzoic acid, 3-[(methylamino)methyl]-, methyl ester, hydrochloride (1:1)
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