Cas no 105804-05-5 (Pyrazolo[5,1-a]isoquinolin-5(6H)-one, 2-[3-(trifluoromethyl)phenyl]-)
![Pyrazolo[5,1-a]isoquinolin-5(6H)-one, 2-[3-(trifluoromethyl)phenyl]- structure](https://ossimg.kuujia.com/scimg/106000/105804-05-5x500.png)
105804-05-5 structure
Product Name:Pyrazolo[5,1-a]isoquinolin-5(6H)-one, 2-[3-(trifluoromethyl)phenyl]-
CAS No:105804-05-5
MF:C18H11F3N2O
MW:328.287954568863
CID:1161148
Update Time:2024-07-26
Pyrazolo[5,1-a]isoquinolin-5(6H)-one, 2-[3-(trifluoromethyl)phenyl]- Chemical and Physical Properties
Names and Identifiers
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- Pyrazolo[5,1-a]isoquinolin-5(6H)-one, 2-[3-(trifluoromethyl)phenyl]-
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- Inchi： 1S/C18H11F3N2O/c19-18(20,21)13-6-3-5-12(8-13)15-10-16-14-7-2-1-4-11(14)9-17(24)23(16)22-15/h1-8,10H,9H2
- InChI Key： UFHHZWSIFPTVOP-UHFFFAOYSA-N
- SMILES： C12=CC(C3=CC=CC(C(F)(F)F)=C3)=NN1C(=O)CC1=C2C=CC=C1
Computed Properties
- Exact Mass: 328.08243
Experimental Properties
- Density: 1.39±0.1 g/cm3(Predicted)
- Melting Point: 223-224 °C
- Boiling Point: 507.5±60.0 °C(Predicted)
- PSA: 34.89
- pka: -2.71±0.20(Predicted)
Pyrazolo[5,1-a]isoquinolin-5(6H)-one, 2-[3-(trifluoromethyl)phenyl]- Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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