96551-22-3

• 常用中文名：3-羟基甲基吲哚-1-羧酸叔丁酯
• 常用英文名：1-Boc-3-Hydroxymethylindole
• CAS号：96551-22-3
• 分子式：C₁₄H₁₇NO₃
• 分子量：247.290
• 发布时间：2018-06-15 11:17:30
• 更新时间：2026-07-21 15:58:00

名称

• 中文名: 3-羟基甲基吲哚-1-羧酸叔丁酯
• 英文名: 1-Boc-3-Hydroxymethylindole
• 中文别名: 3-羟基甲基吲哚-1-甲酸叔丁酯; N-BOC-3-(羟甲基)吲哚; 3-羟基甲基吲哚-1-羧酸叔丁; 3-(羟甲基)-1H-吲哚-1-甲酸叔丁酯; 1-BOC-3-羟甲基吲哚; 3-羟甲基吲哚-1-羧酸叔丁酯
• 英文别名: t-butyl 3-hydroxymethylindole-1-cboxylate; 3-(Hydroxymethyl)-1H-indole-1-cboxylic acid tert-butyl ester; 3-HydroxyMethyl-1H-indole-1-cboxylic Acid 1,1-DiMethylethyl Ester; 3-(Hydroxymethyl)-1H-indole, N-BOC protected; 3-(Hydroxymethyl)indole, N-BOC; tert-Butyl 3-(hydroxyMethyl)indole-1-cboxylate; 3-(HYDROXYMETHYL)INDOLE, N-BOC PROTECTED; N-BOC-3-(HYDROXYMETHYL)INDOLE; 1H-Indole-1-carboxylic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester; Benzene,1-ethenyl-6-nitro; 3-HYDROXYMETHYLINDOLE-1-CBOXYLIC ACID TERT-BUTYL ESTER; 2-Methyl-2-propanyl 3-(hydroxymethyl)-1H-indole-1-carboxylate; 3-(Hydroxymethyl)-1H-indole-1-carboxylic acid tert-butyl ester; TERT-BUTYL 3-(HYDROXYMETHYL)-1H-INDOLE-1-CBOXYLATE; Ethanol,7-diazenyl; tert-butyl 3-(hydroxymethyl)indole-1-carboxylate; 3-(HYDROXYMETHYL)-1H-INDOLE-1-CBOXYLATE; 1-BOC-3-HYDROXYMETHYL-INDOLE; tert-Butyl 3-(hydroxymethyl)-1H-indole-1-carboxylate; 3-(Hydroxymethyl)-1H-indole-1-carboxylic acid tert-butylester

物化性质

• 密度: 1.1±0.1 g/cm3
• 沸点: 396.0±34.0 °C at 760 mmHg
• 分子式: C₁₄H₁₇NO₃
• 分子量: 247.290
• 闪点: 193.3±25.7 °C
• 精确质量: 247.120850
• PSA: 51.46000
• LogP: 2.68
• 蒸汽压: 0.0±1.0 mmHg at 25°C
• 折射率: 1.553
• 储存条件: 2-8°C

安全

• 危害码 (欧洲): Xi: Irritant;
• 海关编码: 2933990090

合成路线

57476-50-3 ~99% 96551-22-3

文献：Schoellkopf, Ulrich; Lonsky, Ralph; Lehr, Philipp Liebigs Annalen der Chemie, 1985 , # 2 p. 413 - 417

338760-26-2 ~99% 96551-22-3

文献：Takeda Pharmaceutical Company Limited Patent: EP1559422 A1, 2005 ; Location in patent: Page/Page column 130 ; EP 1559422 A1

487-89-8 24424-99-5 ~% 96551-22-3

文献：WO2008/110793 A1, ; Page/Page column 111 ;

700-06-1 24424-99-5 ~99% 96551-22-3

文献：Hsu, He-Chu; Hou, Duen-Ren Tetrahedron Letters, 2009 , vol. 50, # 51 p. 7169 - 7171

487-89-8 ~% 96551-22-3

文献：Bioorganic and Medicinal Chemistry, , vol. 11, # 23 p. 5059 - 5068

24424-99-5 ~% 96551-22-3

文献：Bioorganic and Medicinal Chemistry, , vol. 11, # 23 p. 5059 - 5068

34619-03-9 ~% 96551-22-3

文献：Liebigs Annalen der Chemie, , # 2 p. 413 - 417

上下游产品

上游产品  6
57476-50-3 338760-26-2 487-89-8 24424-99-5
700-06-1 34619-03-9
下游产品  3
57476-50-3 96551-21-2 114604-96-5

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%