377112
3-吡咯啉
95%
别名:
2,5-二氢吡咯
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关于此项目
经验公式（希尔记法）:
C4H7N
化学文摘社编号:
分子量:
69.11
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
203-723-1
Beilstein/REAXYS Number:
103173
MDL number:
Assay:
95%
Form:
liquid
InChI key
JVQIKJMSUIMUDI-UHFFFAOYSA-N
InChI
1S/C4H7N/c1-2-4-5-3-1/h1-2,5H,3-4H2
SMILES string
C1NCC=C1
assay
95%
form
liquid
Quality Level
bp
90-91 °C/748 mmHg (lit.)
density
0.91 g/mL at 25 °C (lit.)
storage temp.
−20°C
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General description
3-吡咯啉是一种杂环结构单元。利用基于振动耦合模型的哈密顿模型研究了 3-吡咯啉的激发态动力学。报告了一种合成 3-吡咯啉结构单元的新方法。3-吡咯啉被报告为合成功能化吡咯啉、吡咯烷和其他天然产物的非常有用的中间体。报告了以 ( Z )-1，4-二氯-2-丁烯为原料，通过 Delépine 反应合成 3-吡咯啉（2，5-二氢-1 H -吡咯）的方法。在 N -（ 叔 -丁氧基羰基）-3-吡咯啉合成中作为中间体形成。报告了 Me 3 Al 和 Me 3 Ga 与 3-吡咯啉的反应。
通过两步烷基化/亚烷基卡宾 CH 插入反应，合成了各种 3-吡咯啉（2,5-二氢吡咯）。以 顺式 -1,4-二氯-2-丁烯为起始原料合成 3-吡咯啉。
Application
3-吡咯啉适用于通过 X 射线光电子能谱 (XPS) 研究键合在 Si (001) 表面上的简单不饱和有机分子的核心水平结合能。它可用于合成肾素抑制剂 和血管扩张剂。
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Flam. Liq. 2 - Skin Corr. 1A
存储类别
3 - Flammable liquids
wgk
WGK 2
flash_point_f
-0.4 °F - closed cup
flash_point_c
-18 °C - closed cup
ppe
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
法规信息
危险化学品
此项目有
S H Rosenberg et al.
Journal of medicinal chemistry, 33(7), 1962-1969 (1990-07-01)
Incorporation of nonreactive polar functionalities at the C- and N-termini of renin inhibitors led to the development of a subnanomolar compound (21) with millimolar solubility. This inhibitor demonstrated excellent efficacy and a long duration of action upon intravenous administration to
A modified procedure for the preparation of 2, 5-dihydropyrrole (3-pyrroline).
Warmus JS, et al.
The Journal of Organic Chemistry, 58(1), 270-271 (1993)
S P Neville et al.
The journal of physical chemistry. A, 118(51), 11975-11986 (2014-09-16)
A model Hamiltonian based on the vibronic coupling model is developed to describe the excited state dynamics of 3-pyrroline. With the use of the method of improved relaxation in conjunction with the MCTDH wavepacket propagation algorithm, vibrational eigenstates corresponding to
A convenient route to 3-pyrroline utilizing the Delepine reaction.
Brandange S and Rodriguez B.
Synthesis, 4 , 347-348 (1988)
Nobuyoshi Morita et al.
Organic letters, 6(22), 4121-4123 (2004-10-22)
[reaction: see text] The gold(III) chloride-catalyzed cycloisomerization of various alpha-aminoallenes gave the corresponding 3-pyrrolines in good to high chemical yields. An interesting dependence of the chirality transfer and reactivity on the N-protecting group was observed. The 3-pyrrolines are highly useful
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