Cas no 78901-42-5 (1H,5H-Pyrazolo[1,2-a]pyrazole-1,5-dione-3-d, 7-methyl- (9CI))
![1H,5H-Pyrazolo[1,2-a]pyrazole-1,5-dione-3-d, 7-methyl- (9CI) structure](https://ossimg.kuujia.com/scimg/79000/78901-42-5x500.png)
78901-42-5 structure
Product Name:1H,5H-Pyrazolo[1,2-a]pyrazole-1,5-dione-3-d, 7-methyl- (9CI)
CAS No:78901-42-5
MF:C7H6N2O2
MW:151.140902996063
CID:553635
Update Time:2023-03-29
1H,5H-Pyrazolo[1,2-a]pyrazole-1,5-dione-3-d, 7-methyl- (9CI) Chemical and Physical Properties
Names and Identifiers
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- 1H,5H-Pyrazolo[1,2-a]pyrazole-1,5-dione-3-d,7-methyl- (9CI)
- 1H,5H-Pyrazolo[1,2-a]pyrazole-1,5-dione-3-d, 7-methyl- (9CI)
-
- Inchi： 1S/C7H6N2O2/c1-5-4-7(11)8-3-2-6(10)9(5)8/h2-4H,1H3/i3D
- InChI Key： RZPAGIHJISBOSK-WFVSFCRTSA-N
- SMILES： N12C(=O)C=C(C)N1C(=O)C=C2[2H]
Computed Properties
- Exact Mass: 151.049
- Monoisotopic Mass: 151.049
- Isotope Atom Count: 1
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 304
- 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: 40.6A^2
1H,5H-Pyrazolo[1,2-a]pyrazole-1,5-dione-3-d, 7-methyl- (9CI) Related Literature
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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