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CAS 1177093-05-8

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1,3-Benzodioxole-5-propanoic acid, β-amino-, methyl ester, hydrochloride (1:1)

Description:
1,3-Benzodioxole-5-propanoic acid, β-amino-, methyl ester, hydrochloride (1:1), identified by CAS number 1177093-05-8, is a chemical compound characterized by its unique structure that includes a benzodioxole moiety, a propanoic acid group, and a β-amino acid derivative. This compound typically appears as a white to off-white crystalline solid and is soluble in water and various organic solvents, which is indicative of its polar functional groups. The presence of the hydrochloride salt form suggests enhanced stability and solubility, making it suitable for various applications in pharmaceuticals and biochemistry. Its β-amino acid structure may impart interesting biological properties, potentially influencing its interaction with biological systems. The compound's synthesis and characterization would involve standard organic chemistry techniques, and it may be of interest in medicinal chemistry for its potential therapeutic effects. As with any chemical substance, proper handling and safety protocols should be observed due to its biological activity and potential toxicity.
Formula:C11H13NO4·ClH
InChI:InChI=1S/C11H13NO4.ClH/c1-14-11(13)5-8(12)7-2-3-9-10(4-7)16-6-15-9;/h2-4,8H,5-6,12H2,1H3;1H
InChI key:InChIKey=IVKKOAMWYVPZCG-UHFFFAOYSA-N
SMILES:C(CC(OC)=O)(N)C=1C=C2C(=CC1)OCO2.Cl
Synonyms:
  • 1,3-Benzodioxole-5-propanoic acid, β-amino-, methyl ester, hydrochloride (1:1)
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