3-​(Aminomethyl)​-​5-​methyl-hexanoic Acid Phenylmethyl Ester Hydrochloride

CAS: 649748-11-8

Ref. TR-A631015

Informação sobre produto

• Nome: 3-​(Aminomethyl)​-​5-​methyl-hexanoic Acid Phenylmethyl Ester Hydrochloride
• Sinónimos: Benzyl 3-(Aminomethyl)-5-methylhexanoate Hydrochloride, Hexanoic acid, 3-(aminomethyl)-5-methyl-, phenylmethyl ester, hydrochloride, (3S)-, Hexanoic acid, 3-(aminomethyl)-5-methyl-, phenylmethyl ester, hydrochloride (1:1), (3S)-, (S)-Benzyl 3-(aminomethyl)-5-methylhexanoate hydrochloride

Descrição

Applications 3-​(Aminomethyl)​-​5-​methyl-hexanoic Acid Phenylmethyl Ester Hydrochloride is an intermediate in synthesizing 4,9-Diisobutyl-1,6-diazecane-2,7-dione (D456300), an impurity of rac-Pregabalin (P704800) which is a GABA analogue used as an anticonvulsant.
References Taylor, C.P., at al.: Epilepsy Res., 14, 11 (1993), Field, M.J., et al.: Pain, 80, 391 (1999)

• Marca: TRC

Propriedades químicas

• Peso molecular: 249.35 + (36.46)
• Fórmula: C₁₅H₂₃NO₂•HCl
• Cor/forma: White Solid
• InChI: InChI=1S/C15H23NO2.ClH/c1-12(2)8-14(10-16)9-15(17)18-11-13-6-4-3-5-7-13;/h3-7,12,14H,8-11,16H2,1-2H3;1H
• Chave InChI: InChIKey=QIWHJSXQFMZAPS-UHFFFAOYSA-N
• SMILES: CC(C)CC(CN)CC(=O)OCc1ccccc1.Cl