423165-13-3

• 常用中文名：8-苄基-3-外型-(5-异丙基-3-甲基-4H-1,2,4-三唑-4-基)-8-氮杂双环[3.2.1]辛烷
• 常用英文名：8-benzyl-3-exo-(3-isopropyl-5-methyl-4h-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane
• CAS号：423165-13-3
• 分子式：C₂₀H₂₈N₄
• 分子量：324.463
• 相关类别： 医药中间体 原料药中间体
• 发布时间：2018-10-21 18:36:10
• 更新时间：2024-01-02 10:22:19

名称

• 中文名: 8-苄基-3-外型-(5-异丙基-3-甲基-4H-1,2,4-三唑-4-基)-8-氮杂双环[3.2.1]辛烷
• 英文名: (1R,3s,5S)-8-Benzyl-3-(3-isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane
• 中文别名: 3-[3-甲基-5-异丙基-4H-1,2,4-三氮唑]-8-苄基-8-氮杂双环[3,2,1]辛烷
• 英文别名: 8-Azabicyclo[3.2.1]octane, 3-[3-methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-8-(phenylmethyl)-, (3-exo); (3-exo)-8-Benzyl-3-(3-isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane; 8-Benzyl-3-exo-(3-isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane

物化性质

• 密度: 1.2±0.1 g/cm3
• 沸点: 481.5±55.0 °C at 760 mmHg
• 熔点: 149ºC
• 分子式: C₂₀H₂₈N₄
• 分子量: 324.463
• 闪点: 245.0±31.5 °C
• 精确质量: 324.231384
• PSA: 33.95000
• LogP: 2.96
• 蒸汽压: 0.0±1.2 mmHg at 25°C
• 折射率: 1.649
• 储存条件: 2-8°C

安全

• 海关编码: 2933990090

合成路线

376348-67-3 1068-57-1 ~63% 423165-13-3

文献：Auspex Pharmaceuticals, Inc. Patent: US2008/146605 A1, 2008 ; Location in patent: Page/Page column 41 ;

376348-67-3 6292-65-5 ~74% 423165-13-3

文献：Haycock-Lewandowski, Sarah J.; Wilder, Alexander; Ahman, Jens Organic Process Research and Development, 2008 , vol. 12, # 6 p. 1094 - 1103

76272-36-1 ~% 423165-13-3

文献：Asano, Shigehiro; Gavrilyuk, Julia; Burton, Dennis R.; Barbas, Carlos F. ACS Medicinal Chemistry Letters, 2014 , vol. 5, # 2 p. 133 - 137

376348-67-3 ~% 423165-13-3

文献：Asano, Shigehiro; Gavrilyuk, Julia; Burton, Dennis R.; Barbas, Carlos F. ACS Medicinal Chemistry Letters, 2014 , vol. 5, # 2 p. 133 - 137

76272-34-9 ~% 423165-13-3

文献：SHANGHAI TARGETDRUG CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES Patent: US2011/251192 A1, 2011 ; US 20110251192 A1

132259-54-2 ~% 423165-13-3

文献：Asano, Shigehiro; Gavrilyuk, Julia; Burton, Dennis R.; Barbas, Carlos F. ACS Medicinal Chemistry Letters, 2014 , vol. 5, # 2 p. 133 - 137

28957-72-4 ~% 423165-13-3

文献：SHANGHAI TARGETDRUG CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES Patent: US2011/251192 A1, 2011 ; US 20110251192 A1

542-05-2 ~% 423165-13-3

文献：SHANGHAI TARGETDRUG CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES Patent: US2011/251192 A1, 2011 ; US 20110251192 A1

100-46-9 ~% 423165-13-3

文献：SHANGHAI TARGETDRUG CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES Patent: US2011/251192 A1, 2011 ; US 20110251192 A1

上下游产品

上游产品  9
376348-67-3 1068-57-1 6292-65-5 76272-36-1
76272-34-9 132259-54-2 28957-72-4 542-05-2
100-46-9
下游产品  4
423165-07-5 376348-70-8 376348-65-1 423165-08-6

海关

海关编码	2933990090
中文概述	2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素	品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%