Cas no 71925-09-2 (1H-Imidazole-5-carboxylicacid, 1-ethenyl-, ethyl ester)
71925-09-2 structure
Product Name:1H-Imidazole-5-carboxylicacid, 1-ethenyl-, ethyl ester
CAS No:71925-09-2
MF:C8H10N2O2
MW:166.177201747894
CID:548610
Update Time:2022-07-26
1H-Imidazole-5-carboxylicacid, 1-ethenyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- 1H-Imidazole-5-carboxylicacid, 1-ethenyl-, ethyl ester
- 1H-Imidazole-5-carboxylicacid,1-ethenyl-,ethylester(9CI)
- 1H-Imidazole-5-carboxylic acid, 1-ethenyl-, ethyl ester
-
- Inchi： 1S/C8H10N2O2/c1-3-10-6-9-5-7(10)8(11)12-4-2/h3,5-6H,1,4H2,2H3
- InChI Key： PTMZLDORWSXZEQ-UHFFFAOYSA-N
- SMILES： C1N(C=C)C(C(OCC)=O)=CN=1
Computed Properties
- Exact Mass: 166.074
- Monoisotopic Mass: 166.074
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 182
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 44.1A^2
1H-Imidazole-5-carboxylicacid, 1-ethenyl-, ethyl ester Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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