01
反应 #4083411
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:10.1039/C8SC04228D
反应条件: temp:0.00; pressure:0.00; stir:
来源 ID: ord-d0e24dc54229434899f16b396038b3112D 化学结构数据库编号 13352438
暂无可渲染的结构数据
SMILES
CC(C)CC(C#N)N——
产品信息
2-氨基-4-甲基戊腈
2-氨基-4-甲基戊腈（CAS 65451-12-9）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65451-12-9
数据库编号13352438
分子式—
更新时间2023-01-08
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可能的应用方向
仅供专业研发与工业用途
数据库编号 13352438
计算性质
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XLogP—
拓扑极性表面积—
氢键供体数—
氢键受体数—
可旋转键数—
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- CC(C)CC(C#N)N
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合成路线数据
相关反应
7 条反应 · 7 篇文献
02
反应 #3329984
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:US09290451B2
反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: The title compound was synthesized in analogy to Example 1, using 5-cyclopropyl-6-cyclopropylmethyloxy-pyridine-2-carboxylic acid (Example 42a) and 2-amino-4-methyl-pentanenitrile (CAN 65451-12-9) as starting materials. The product was isolated by chiral chromatography on Reprosil Chiral NR using heptane/15% ethanol as eluent. The (−)-enantiomer was isolated. LC-MS (UV peak area/ESI) 100%, 328.2026 (M+H)+, αD20 (MeOH)=−8.0°. The product was isolated by chiral chromatography on Reprosil Chiral NR The (−)-enantiomer was isolated
来源 ID: ord-c43f5cab12614784813605ee053b6c8903
反应 #3101027
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:US09321727B2
反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: The title compound was synthesized in analogy to Example 1, using 5-cyclopropyl-6-cyclopropylmethyloxy-pyridine-2-carboxylic acid (Example 42a) and 2-amino-4-methyl-pentanenitrile (CAN 65451-12-9) as starting materials. The product was isolated by chiral chromatography on Reprosil Chiral NR using heptane/15% ethanol as eluent. The (−)-enantiomer was isolated. LC-MS (UV peak area/ESI) 100%, 328.2026 (M+H)+, αD20 (MeOH)=−8.0°. The product was isolated by chiral chromatography on Reprosil Chiral NR The (−)-enantiomer was isolated
来源 ID: ord-519fa224c7bf45948b3a8973af9fc7f904
反应 #3101026
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:US09321727B2
反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: The title compound was synthesized in analogy to Example 1, using 5-cyclopropyl-6-cyclopropylmethyloxy-pyridine-2-carboxylic acid (Example 42a) and 2-amino-4-methyl-pentanenitrile (CAN 65451-12-9) as starting materials. The product was isolated by chiral chromatography on Reprosil Chiral NR using heptane/15% ethanol as eluent. The (−)-enantiomer was isolated. LC-MS (UV peak area/ESI) 100%, 328.2026 (M+H)+, αD20 (MeOH)=−8.0°. The product was isolated by chiral chromatography on Reprosil Chiral NR The (−)-enantiomer was isolated
来源 ID: ord-519fa224c7bf45948b3a8973af9fc7f905
反应 #2451819
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:10.1039/C8SC04228D
反应条件: temp:0.00; pressure:0.00; stir:
来源 ID: ord-d0e24dc54229434899f16b396038b31106
反应 #842718
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:US09290451B2
反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: The title compound was synthesized in analogy to Example 1, using 5-cyclopropyl-6-cyclopropylmethyloxy-pyridine-2-carboxylic acid (Example 42a) and 2-amino-4-methyl-pentanenitrile (CAN 65451-12-9) as starting materials. The product was isolated by chiral chromatography on Reprosil Chiral NR using heptane/15% ethanol as eluent. The (−)-enantiomer was isolated. LC-MS (UV peak area/ESI) 100%, 328.2026 (M+H)+, αD20 (MeOH)=−8.0°. The product was isolated by chiral chromatography on Reprosil Chiral NR The (−)-enantiomer was isolated
来源 ID: ord-c43f5cab12614784813605ee053b6c8907
反应 #646301
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:US09321727B2
反应条件: temp:0.00; pressure:0.00; stir:; See reaction.notes.procedure_details.
实验步骤: The title compound was synthesized in analogy to Example 1, using 5-cyclopropyl-6-cyclopropylmethyloxy-pyridine-2-carboxylic acid (Example 42a) and 2-amino-4-methyl-pentanenitrile (CAN 65451-12-9) as starting materials. The product was isolated by chiral chromatography on Reprosil Chiral NR using heptane/15% ethanol as eluent. The (−)-enantiomer was isolated. LC-MS (UV peak area/ESI) 100%, 328.2026 (M+H)+, αD20 (MeOH)=−8.0°. The product was isolated by chiral chromatography on Reprosil Chiral NR The (−)-enantiomer was isolated
来源 ID: ord-519fa224c7bf45948b3a8973af9fc7f9PubChem 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。