N-​[1-​(2-​Chlorophenyl)​-​2-​oxocyclohexyl]​-​carbamic Acid 1,​1-​Dimethylethyl Ester

CAS: 2177263-88-4

Ref. TR-C422205

Informação sobre produto

• Nome: N-​[1-​(2-​Chlorophenyl)​-​2-​oxocyclohexyl]​-​carbamic Acid 1,​1-​Dimethylethyl Ester
• Sinónimos: N-[1-(2-chlorophenyl)-2-oxocyclohexyl]-carbamic acid, 1,1-dimethylethyl ester

Descrição

Applications N-​[1-​(2-​Chlorophenyl)​-​2-​oxocyclohexyl]​-​carbamic Acid 1,​1-​Dimethylethyl Ester is an intermediate in synthesizing Hydroxynorketamine Hydrochloride (H949680). It is a metabolite of Ketamine (K165300, HCl salt) which is a medication used mainly for starting and maintaining anesthesia.
References Adams, J., et al.: Biomed. Mass Spec., 11, 527 (1981); Sass, W.C., et al.: Anal. Profiles Drug Subs., 6, 297 (1977); Reich, D.L., et al.: Can. J. Anaesth., 36, 186 (1989)

• Marca: TRC

Propriedades químicas

• Peso molecular: 323.81
• Fórmula: C₁₇H₂₂ClNO₃
• Cor/forma: Neat
• InChI: InChI=1S/C17H22ClNO3/c1-16(2,3)22-15(21)19-17(11-7-6-10-14(17)20)12-8-4-5-9-13(12)18/h4-5,8-9H,6-7,10-11H2,1-3H3,(H,19,21)
• Chave InChI: InChIKey=VRZJVQFAJVIUAX-UHFFFAOYSA-N
• SMILES: CC(C)(C)OC(=O)NC1(c2ccccc2Cl)CCCCC1=O