Cas no 280574-40-5 (2,4-Cyclohexadien-1-one,2-hydroxy-6-[(methylamino)methylene]-, (6Z)-)
![2,4-Cyclohexadien-1-one,2-hydroxy-6-[(methylamino)methylene]-, (6Z)- structure](https://ossimg.kuujia.com/scimg/281000/280574-40-5x500.png)
280574-40-5 structure
Product Name:2,4-Cyclohexadien-1-one,2-hydroxy-6-[(methylamino)methylene]-, (6Z)-
CAS No:280574-40-5
MF:C8H9NO2
MW:151.162562131882
CID:248280
Update Time:2024-01-26
2,4-Cyclohexadien-1-one,2-hydroxy-6-[(methylamino)methylene]-, (6Z)- Chemical and Physical Properties
Names and Identifiers
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- 2,4-Cyclohexadien-1-one,2-hydroxy-6-[(methylamino)methylene]-, (6Z)-
- 2,4-Cyclohexadien-1-one, 2-hydroxy-6-[(methylamino)methylene]-, (6Z)- (9CI)
- 2,4-Cyclohexadien-1-one, 2-hydroxy-6-[(methylamino)methylene]-, (6Z)-
-
- Inchi： 1S/C8H9NO2/c1-9-5-6-3-2-4-7(10)8(6)11/h2-5,9-10H,1H3/b6-5-
- InChI Key： KFGLFWIRTMJWJT-WAYWQWQTSA-N
- SMILES： C1(=O)/C(=C\NC)/C=CC=C1O
Computed Properties
- Exact Mass: 151.06337
- Monoisotopic Mass: 151.063
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 261
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 49.3A^2
Experimental Properties
- PSA: 49.33
2,4-Cyclohexadien-1-one,2-hydroxy-6-[(methylamino)methylene]-, (6Z)- Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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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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