142643-29-6
基本信息
3-叔丁氧羰基氨基哌啶
3-叔丁氧羰基氨甲基哌啶
3-BOC-氨基哌啶
3-BOC-氨基甲基-哌啶
3-AMINOPIPERIDINE, 3-BOC PROTECTED
(+/-)-3-(BOC-AMINOMETHYL)PIPERIDINE
3-BOC-AMINOMETHYL PIPERIDINE
3-BOC-AMINOPIPERIDINE
3-N-BOC-AMINOMETHYL PIPERIDINE
(+/-)-3-N-BOC-AMINO-PIPERIDINE
3-N-BOC-AMINO PIPERIDINE
3-(TERT-BUTOXYCARBONYLAMINO)PIPERIDINE
CARBAMIC ACID, 3-PIPERIDINYL-, 1,1-DIMETHYLETHYL ESTER
PIPERIDIN-3-YL-CARBAMIC ACID TERT-BUTYL ESTER
PIPERIDIN-3-YLMETHYL-CARBAMIC ACID TERT-BUTYL ESTER
(R)-PIPERIDIN-3-YLMETHYL-CARBAMIC ACID TERT-BUTYL ESTER
(R,S)-(BOC-3-AMINOMETHYL)-PIPERIDINE
(S)-PIPERIDIN-3-YLMETHYL-CARBAMIC ACID TERT-BUTYL ESTER
TERT-BUTYL N-(3-PIPERIDYLMETHYL)CARBAMATE
TERT-BUTYL PIPERIDIN-3-YLCARBAMATE
TERT-BUTYL (PIPERIDIN-3-YLMETHYL) CARBAMATE
3-Aminopiperidine, 3-BOC protected 97%
3-BOC-3-AMINOPIPERIDINE
物理化学性质
| 熔点 | 60-70 °C(lit.) |
| 沸点 | 321.8±15.0 °C(Predicted) |
| 密度 | 0.981 |
| 储存条件 | 2-8°C |
| 酸度系数(pKa) | 12.71±0.46(Predicted) |
| 形态 | solid |
| 颜色 | White |
| BRN | 7023643 |
| InChI | 1S/C11H22N2O2/c1-11(2,3)15-10(14)13-8-9-5-4-6-12-7-9/h9,12H,4-8H2,1-3H3,(H,13,14) |
| InChIKey | KHPQHXGYYXYTDN-UHFFFAOYSA-N |
| SMILES | CC(C)(C)OC(=O)NCC1CCCNC1 |
| CAS 数据库 | 142643-29-6(CAS DataBase Reference) |
安全数据
| 危险性符号(GHS) |  GHS05 |
| 警示词 | 危险 |
| 危险性描述 | H314 |
| 防范说明 | P260-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338-P363 |
| 危险品标志 | C,Xi |
| 危险类别码 | R34 |
| 安全说明 | S26-S36/37/39-S45 |
| 危险品运输编号 | UN 3259 8/PG 2 |
| WGK Germany | 3 |
| Hazard Note | Irritant |
| 危险等级 | IRRITANT |
| 海关编码 | 29333990 |
| 存储类别 | 8A - Combustible corrosive hazardous materials |
| 危险性类别 | Skin Corr. 1B |
制备方法
220031-61-8
142643-29-6
向（1-苄基哌啶-3-基）甲基氨基甲酸叔丁酯（2.05 g，6.74 mmol，1.0当量）的甲醇（40 mL）溶液中加入10% Pd(OH)2/C（0.21 g，10 wt%）。在氩气保护下，向反应体系中加入环己烯（6.80 mL，67.40 mmol，10.0当量）。将所得悬浮液在氩气氛围下回流20小时。反应完成后，通过Celite垫（Celite 577 fine）过滤，滤液经减压浓缩得到粗产物。粗产物通过快速柱色谱法纯化，洗脱剂为二氯甲烷/甲醇/三乙胺（3:1:0.1，v/v/v），得到1.31 g目标化合物3-Boc-氨甲基哌啶，为无色粘性油状物。产率：91%；薄层色谱Rf = 0.33（二氯甲烷/甲醇/三乙胺 = 3:1:0.1）；1H NMR (400 MHz, CDCl3) δ: 1.08 (qd, J = 11.2, 4.0 Hz, 1H, CH2CHAHBCH), 1.42 (s, 9H, 3×CH3), 1.45-1.52 (m, 1H, CHAHBCH2CH), 1.58-1.70 (m, 2H, CHAHBCHAHBCH), 1.76-1.82 (m, 1H, CH), 2.32 (t, J = 11.2 Hz, 1H, NHCHAHBCH), 2.52-2.60 (m, 2H, CH2CHAHBNH), 2.97-3.03 (m, 3H, CH2NHCO + CH2CHAHBNH), 3.06 (dd, J = 11.6, 3.2 Hz, 1H, NHCHAHBCH), 4.63 (br s, 1H, NHCO); 13C NMR (100 MHz, CDCl3) δ: 24.99, 27.97, 28.27, 36.86, 43.74, 45.90, 49.54, 78.28, 155.86; ESI-HRMS m/z 计算值 C11H23N2O2 [M+H]+ 215.1760，实测值 215.1763; IR (KBr) υ: 3385, 2978, 2934, 1685, 1528, 1458, 1367, 1272, 1254, 1174, 1009 cm-1。
参考文献：
[1] Bioorganic and Medicinal Chemistry, 2015, vol. 23, # 15, p. 4442 - 4452
[2] Bioorganic and Medicinal Chemistry, 2017, vol. 25, # 2, p. 633 - 645
[3] Journal of Medicinal Chemistry, 2018, vol. 61, # 1, p. 119 - 139
知名试剂公司产品信息
3-Boc-氨甲基哌啶价格(试剂级)
| 报价日期 | 产品编号 | 产品名称 | CAS号 | 包装 | 价格 |
| 2026/06/05 | XW0214264329605 | (±)-3-(Boc-氨基甲基)哌啶 tert-Butyl (piperidin-3-ylmethyl)carbamate | 142643-29-6 | 25g | 1163元 |
| 2026/06/05 | XW0214264329604 | (±)-3-(Boc-氨基甲基)哌啶 tert-Butyl (piperidin-3-ylmethyl)carbamate | 142643-29-6 | 10g | 600元 |
| 2026/06/05 | XW0214264329603 | (±)-3-(Boc-氨基甲基)哌啶 tert-Butyl (piperidin-3-ylmethyl)carbamate | 142643-29-6 | 5g | 387元 |