乙氧甲叉氰乙酸乙酯 | 34-45-7
乙氧甲叉氰乙酸乙酯
Ethyl (ethoxymethylene)cyanoacetate,98%
34-45-7
C8H11NO3
169.17784
名称和标识符
InChIKey |
KTMGNAIGXYODKQ-VOTSOKGWSA-N |
Inchi |
InChI=1S/C8H11NO3/c1-3-11-6-7(5-9)8(10)12-4-2/h6H,3-4H2,1-2H3/b7-6+ |
SMILES |
CCO/C=C(/C(OCC)=O)\C#N |
别名信息
- 英文别名 -
- Ethyl .alpha.-(ethoxymethylene)-.alpha.-cyanoacetate
- Q27261074
- Ethyl (ethoxymethylene)cyanoacetate
- MFCD00009136
- 2-Cyano-3-ethoxyacrylic Acid Ethyl Ester
- EINECS 202-299-5
- DTXSID4059097
- 0F33W9H92I
- NSC 27797
- UNII-53706319OM
- Ethyl (ethoxymethylene)cyanoacetate,98%
- Ethyl 2-cyano-3-ethoxyacrylate, (2E)-
- InChI=1/C8H11NO3/c1-3-11-6-7(5-9)8(10)12-4-2/h6H,3-4H2,1-2H3/b7-6
- AI3-23778
- Ethyl 2-(Ethoxymethylene)-2-cyanoacetate
- W-100217
- 2-Propenoic acid, 2-cyano-3-ethoxy-, ethyl ester
- Acrylic acid, 2-cyano-3-ethoxy-, ethyl ester
- CS-D1211
- A15025
- Ethyl(ethoxymethylene)cyanoacetate,98%
- LS-13436
- ethyl (2E)-2-cyano-3-ethoxyprop-2-enoate
- 34-45-7
- A872883
- GS-4101
- D70133
- ethyl (E)-2-cyano-3-ethoxyprop-2-enoate
- SR-01000944753
- 2-Propenoic acid, 2-cyano-3-ethoxy-, ethyl ester, (2E)-
- Ethyl 2-cyano-3-ethoxyacrylate, purum, >=97.0% (GC)
- Ethyl(ethoxymethylene)cyanoacetate
- Ethyl 2-cyano-3-ethoxyacrylate
- (E)-ethyl 2-cyano-3-ethoxyacrylate
- EC 202-299-5
- AKOS000120675
- SR-01000944753-1
- Ethyl ethoxymethylenecyanoacetate
- 53706319OM
- Z56871461
- ethyl 2-cyano-3-ethoxyprop-2-enoate
- 2-Propenoic acid, 2-cyano-3-ethoxy-, ethyl ester, (E)-
- UNII-0F33W9H92I
- (E)-ethyl2-cyano-3-ethoxyacrylate
- ethyl 2-cyano-3-ethoxy-2-propenoate
- AKOS025149119
- BP-12003
- EN300-17069
- F0001-2258
- Ethyl 2-cyano-3-ethoxyacrylate, 98%
- ethyl (e)-2-cyano-3-ethoxyacrylate
- Acrylic acid, 2-cyano-3-ethoxy-, ethyl ester (6CI,7CI,8CI)
- 2-(Ethoxymethylene)-2-cyanoacetic acid ethyl ester
- 2-Cyano-3-ethoxy-2-propenoic acid ethyl ester
- 42466-67-1
- Ethyl 3-ethoxy-2-cyanoacrylate
- BCP26701
- EN300-309098
- 94-05-3
- 2-Cyano-3-ethoxy-2-propenoic acid ethyl ester
- Ethyl (2E)-2-cyano-3-ethoxy-2-propenoate
- 2-(Ethoxymethylene)-2-cyanoacetic acid ethyl ester
- ethyl (E)-2-cyano-3-ethoxy-2-propenoate
- D70566
- (2E)-ethyl 2-cyano-3-ethoxyacrylate
- E0341
- Ethyl cyano(ethoxymethylene)acetate
物化性质
实验特性
计算特性
精确分子量 |
169.07393 |
氢键供体数量 |
0 |
氢键受体数量 |
4 |
可旋转化学键数量 |
5 |
同位素质量 |
169.07389321g/mol |
重原子数量 |
12 |
复杂度 |
224 |
同位素原子数量 |
0 |
确定原子立构中心数量 |
0 |
不确定原子立构中心数量 |
0 |
确定化学键立构中心数量 |
1 |
不确定化学键立构中心数量 |
0 |
共价键单元数量 |
1 |
疏水参数计算参考值(XlogP) |
1 |
拓扑分子极性表面积 |
59.3Ų |
相关文献
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1.
Copper-catalyzed cyanation of heterocycle C–H bonds with ethyl(ethoxymethylene)cyanoacetate as a cyanating agent and its mechanism
Ze-lin Li,Kang-kang Sun,Chun Cai Org. Chem. Front. 2018 5 1848
-
2.
Copper-mediated C–H cyanation of (hetero)arenes with ethyl (ethoxymethylene)cyanoacetate as a cyanating agent
Chaorong Qi,Xiaohan Hu,Huanfeng Jiang Chem. Commun. 2017 53 7994
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3.
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Synthesis of a poly(amidoxime-hydroxamic acid) cellulose derivative and its application in heavy metal ion removal
Chenlu Jiao,Zhaofa Zhang,Jin Tao,Desuo Zhang,Yuyue Chen,Hong Lin RSC Adv. 2017 7 27787
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C–CN bond formation: an overview of diverse strategies
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