01
反应 #4055108
反应式
暂无可渲染的结构数据
暂无可渲染的结构数据
暂无可渲染的结构数据
相关文献 (1)
openreactiondata ↗doi:10.1039/C8SC04228D
反应条件: temp:0.00; pressure:0.00; stir:
来源 ID: ord-065be5eb5dcb4dbd8f85b1253053d2502D 化学结构数据库编号 100148
暂无可渲染的结构数据
SMILES
CC(C)(C)OC(=O)NC(CCCCN)C(=O)O——
结构数据已核验 · 数据库编号 100148
中间体产品
DL-Lysine-Boc
6-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid
CAS 186706-75-2Product ID 293701
✓
产品信息已核验
结构、标识符和计算性质已按 CAS 与数据库记录完成匹配。
| 中文名称 | DL-Lysine-Boc |
|---|---|
| English name | 6-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid |
| IUPAC 名称 | — |
| CAS号 | 186706-75-2 |
| 数据库编号 | 100148 |
| 分子式 | — |
| 分子量 | — |
产品信息
DL-Lysine-Boc
DL-Lysine-Boc（CAS 186706-75-2）的产品身份、结构标识及相关反应资料，供化学中间体检索、研发和采购评估使用。
CAS号186706-75-2
数据库编号100148
分子式—
更新时间2023-01-08
可能的应用方向
可能的应用方向
仅供专业研发与工业用途
数据库编号 100148
计算性质
精确质量—
XLogP—
拓扑极性表面积—
氢键供体数—
氢键受体数—
可旋转键数—
- IUPAC 名称
- —
- InChIKey
- —
- SMILES
- CC(C)(C)OC(=O)NC(CCCCN)C(=O)O
- InChI
- —
安全提示
安全与说明
仅供专业研发与工业用途。操作前请依据供应商提供的安全数据表完成风险评估。
合成路线数据
相关反应
5 条反应 · 5 篇文献
02
反应 #2952991
反应式
暂无可渲染的结构数据
+暂无可渲染的结构数据
+暂无可渲染的结构数据
›
暂无可渲染的结构数据
相关文献 (1)
openreactiondata ↗doi:10.6084/m9.figshare.5104873.v1; patent:US09346753B2
反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: A solution of N-α-Boc-L-lysine 18 (5.00 g, 20.3 mmol) in CH2Cl2 (100 mL) was charged with N,N′-bis-Boc-1-guanylpyrazole (5.10 g, 16.6 mmol) and triethylamine (5.54 mL, 40.6 mmol). The reaction mixture was stirred at room temperature for 48 h. The reaction mixture was washed with 10% aqueous citric acid (2×80 mL) and the solvent was removed under reduced pressure. The residue was dissolved in 1 N NaOH (200 mL), the pH of solution was adjusted to 5-6 with 1 N HCl, and the mixture was extracted with CH2Cl2 (300 ml). The CH2Cl2 layer was separated and the aqueous layer was extracted with CH2Cl2 (2×200 mL). The combined organic layers were dried over Na2SO4, filtered, and concentrated to afford compound 10 (9.00 g, 91%) as a white solid: 1H NMR (400 MHz, CD3OD) δ 4.10-4.02 (m, 1H), 3.36 (t, J=6.8 Hz, 2H), 1.90-1.78 (m, 1H), 1.73-1.56 (m, 3H), 1.52 (s, 9H), 1.45-1.31 (m, 2H), 1.47 (s, 9H), 1.43 (s, 9H). The reaction mixture was washed with 10% aqueous citric acid (2×80 mL) the solvent was removed under reduced pressure The residue was dissolved in 1 N NaOH (200 mL) the mixture was extracted with CH2Cl2 (300 ml) The CH2Cl2 layer was separated the aqueous layer was extracted with CH2Cl2 (2×200 mL) The combined organic layers were dried over Na2SO4 filtered concentrated
来源 ID: ord-afa2576d174449438edb55c0cee0d9a803
反应 #2952992
反应式
暂无可渲染的结构数据
+暂无可渲染的结构数据
+暂无可渲染的结构数据
›
暂无可渲染的结构数据
相关文献 (1)
openreactiondata ↗doi:10.6084/m9.figshare.5104873.v1; patent:US09346753B2
反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: A solution of N-α-Boc-L-lysine 18 (5.00 g, 20.3 mmol) in CH2Cl2 (100 mL) was charged with N,N′-bis-Boc-1-guanylpyrazole (5.10 g, 16.6 mmol) and triethylamine (5.54 mL, 40.6 mmol). The reaction mixture was stirred at room temperature for 48 h. The reaction mixture was washed with 10% aqueous citric acid (2×80 mL) and the solvent was removed under reduced pressure. The residue was dissolved in 1 N NaOH (200 mL), the pH of solution was adjusted to 5-6 with 1 N HCl, and the mixture was extracted with CH2Cl2 (300 ml). The CH2Cl2 layer was separated and the aqueous layer was extracted with CH2Cl2 (2×200 mL). The combined organic layers were dried over Na2SO4, filtered, and concentrated to afford compound 10 (9.00 g, 91%) as a white solid: 1H NMR (400 MHz, CD3OD) δ 4.10-4.02 (m, 1H), 3.36 (t, J=6.8 Hz, 2H), 1.90-1.78 (m, 1H), 1.73-1.56 (m, 3H), 1.52 (s, 9H), 1.45-1.31 (m, 2H), 1.47 (s, 9H), 1.43 (s, 9H). The reaction mixture was washed with 10% aqueous citric acid (2×80 mL) the solvent was removed under reduced pressure The residue was dissolved in 1 N NaOH (200 mL) the mixture was extracted with CH2Cl2 (300 ml) The CH2Cl2 layer was separated the aqueous layer was extracted with CH2Cl2 (2×200 mL) The combined organic layers were dried over Na2SO4 filtered concentrated
来源 ID: ord-afa2576d174449438edb55c0cee0d9a804
反应 #2423521
反应式
暂无可渲染的结构数据
+暂无可渲染的结构数据
›
暂无可渲染的结构数据
相关文献 (1)
openreactiondata ↗doi:10.1039/C8SC04228D
反应条件: temp:0.00; pressure:0.00; stir:
来源 ID: ord-065be5eb5dcb4dbd8f85b1253053d25005
反应 #482097
反应式
暂无可渲染的结构数据
+暂无可渲染的结构数据
+暂无可渲染的结构数据
›
暂无可渲染的结构数据
相关文献 (1)
openreactiondata ↗doi:10.6084/m9.figshare.5104873.v1; patent:US09346753B2
反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: A solution of N-α-Boc-L-lysine 18 (5.00 g, 20.3 mmol) in CH2Cl2 (100 mL) was charged with N,N′-bis-Boc-1-guanylpyrazole (5.10 g, 16.6 mmol) and triethylamine (5.54 mL, 40.6 mmol). The reaction mixture was stirred at room temperature for 48 h. The reaction mixture was washed with 10% aqueous citric acid (2×80 mL) and the solvent was removed under reduced pressure. The residue was dissolved in 1 N NaOH (200 mL), the pH of solution was adjusted to 5-6 with 1 N HCl, and the mixture was extracted with CH2Cl2 (300 ml). The CH2Cl2 layer was separated and the aqueous layer was extracted with CH2Cl2 (2×200 mL). The combined organic layers were dried over Na2SO4, filtered, and concentrated to afford compound 10 (9.00 g, 91%) as a white solid: 1H NMR (400 MHz, CD3OD) δ 4.10-4.02 (m, 1H), 3.36 (t, J=6.8 Hz, 2H), 1.90-1.78 (m, 1H), 1.73-1.56 (m, 3H), 1.52 (s, 9H), 1.45-1.31 (m, 2H), 1.47 (s, 9H), 1.43 (s, 9H). The reaction mixture was washed with 10% aqueous citric acid (2×80 mL) the solvent was removed under reduced pressure The residue was dissolved in 1 N NaOH (200 mL) the mixture was extracted with CH2Cl2 (300 ml) The CH2Cl2 layer was separated the aqueous layer was extracted with CH2Cl2 (2×200 mL) The combined organic layers were dried over Na2SO4 filtered concentrated
来源 ID: ord-afa2576d174449438edb55c0cee0d9a8PubChem References
公开参考资料
以下资料来自该化合物的公开数据库参考记录。