Cas no 652982-72-4 (1H-Pyrazole-1-ethanol, 3-phenyl-5-(trifluoromethyl)-)
652982-72-4 structure
Product Name:1H-Pyrazole-1-ethanol, 3-phenyl-5-(trifluoromethyl)-
CAS No:652982-72-4
MF:C12H11F3N2O
MW:256.223753213882
CID:1684827
Update Time:2024-09-03
1H-Pyrazole-1-ethanol, 3-phenyl-5-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrazole-1-ethanol, 3-phenyl-5-(trifluoromethyl)-
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- Inchi： 1S/C12H11F3N2O/c13-12(14,15)11-8-10(16-17(11)6-7-18)9-4-2-1-3-5-9/h1-5,8,18H,6-7H2
- InChI Key： WQGISMLMOMBCAM-UHFFFAOYSA-N
- SMILES： N1(CCO)C(C(F)(F)F)=CC(C2=CC=CC=C2)=N1
Computed Properties
- Exact Mass: 256.08243
Experimental Properties
- Density: 1.30±0.1 g/cm3(Predicted)
- Boiling Point: 365.1±42.0 °C(Predicted)
- PSA: 38.05
- pka: 14.30±0.10(Predicted)
1H-Pyrazole-1-ethanol, 3-phenyl-5-(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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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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