Cas no 856905-34-5 (1H-Pyrazole-4-carboxylic acid, 1-(4-cyanophenyl)-3-(trifluoromethyl)-)
856905-34-5 structure
Product Name:1H-Pyrazole-4-carboxylic acid, 1-(4-cyanophenyl)-3-(trifluoromethyl)-
CAS No:856905-34-5
MF:C12H6F3N3O2
MW:281.190152645111
CID:1840933
Update Time:2024-11-26
1H-Pyrazole-4-carboxylic acid, 1-(4-cyanophenyl)-3-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrazole-4-carboxylic acid, 1-(4-cyanophenyl)-3-(trifluoromethyl)-
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- Inchi： 1S/C12H6F3N3O2/c13-12(14,15)10-9(11(19)20)6-18(17-10)8-3-1-7(5-16)2-4-8/h1-4,6H,(H,19,20)
- InChI Key： RYZSDPFPJRMPSR-UHFFFAOYSA-N
- SMILES： N1(C2=CC=C(C#N)C=C2)C=C(C(O)=O)C(C(F)(F)F)=N1
Experimental Properties
- Density: 1.48±0.1 g/cm3(Predicted)
- Boiling Point: 438.9±45.0 °C(Predicted)
- pka: 2?+-.0.36(Predicted)
1H-Pyrazole-4-carboxylic acid, 1-(4-cyanophenyl)-3-(trifluoromethyl)- Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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5. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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