Cas no 767236-09-9 (1H-Imidazole-5-ethanamine,1,4-dimethyl-(9CI))
767236-09-9 structure
Product Name:1H-Imidazole-5-ethanamine,1,4-dimethyl-(9CI)
1H-Imidazole-5-ethanamine,1,4-dimethyl-(9CI) Chemical and Physical Properties
Names and Identifiers
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- 1H-Imidazole-5-ethanamine,1,4-dimethyl-
- 1H-Imidazole-5-ethanamine,1,4-dimethyl-(9CI)
- 1H-Imidazole-5-ethanamine, 1,4-dimethyl-
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- Inchi: 1S/C7H13N3/c1-6-7(3-4-8)10(2)5-9-6/h5H,3-4,8H2,1-2H3
- InChI Key: DEISJAPIMHAIDI-UHFFFAOYSA-N
- SMILES: C1N(C)C(CCN)=C(C)N=1
Computed Properties
- Exact Mass: 139.111
- Monoisotopic Mass: 139.111
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 105
- 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: 43.8A^2
- XLogP3: -0.2
1H-Imidazole-5-ethanamine,1,4-dimethyl-(9CI) Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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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
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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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