Cas no 70806-24-5 (potassium (E)-2-cyanoethenolate)
70806-24-5 structure
Product Name:potassium (E)-2-cyanoethenolate
CAS No:70806-24-5
MF:C3H2KNO
MW:107.152381420135
CID:1747041
PubChem ID:23703107
Update Time:2025-04-21
potassium (E)-2-cyanoethenolate Chemical and Physical Properties
Names and Identifiers
-
- potassium (E)-2-cyanoethenolate
- potassium,3-oxopropanenitrile
- Ethanone, 2-(1H-imidazol-1-yl)-1-(6-methyl-2-naphthalenyl)-, monohydrochloride
- 70806-24-5
- Ethanone, 2-(1H-imidazol-1-yl)-1-(6-methyl-2-naphthalenyl)-
- DTXSID00221071
- 2-(1H-Imidazol-1-yl)-1-(6-methyl-2-naphthalenyl)ethanone monohydrochloride
-
- Inchi： 1S/C3H2NO.K/c4-2-1-3-5;/h1,3H;/q-1;+1
- InChI Key： WEBQGXXWZXNEQW-UHFFFAOYSA-N
- SMILES： [K+].O=C[CH-]C#N
Computed Properties
- Exact Mass: 106.97736
- Monoisotopic Mass: 106.97734517g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 6
- Rotatable Bond Count: 1
- Complexity: 72.1
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 40.9?2
Experimental Properties
- PSA: 46.85
potassium (E)-2-cyanoethenolate Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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