Cas no 648888-83-9 (5-Thiazolecarboxylic acid,4-(hydroxymethyl)-2-[4-(trifluoromethyl)phenyl]-)
![5-Thiazolecarboxylic acid,4-(hydroxymethyl)-2-[4-(trifluoromethyl)phenyl]- structure](https://ossimg.kuujia.com/scimg/649000/648888-83-9x500.png)
648888-83-9 structure
Product Name:5-Thiazolecarboxylic acid,4-(hydroxymethyl)-2-[4-(trifluoromethyl)phenyl]-
CAS No:648888-83-9
MF:C12H8F3NO3S
MW:303.257032394409
CID:413478
Update Time:2024-01-29
5-Thiazolecarboxylic acid,4-(hydroxymethyl)-2-[4-(trifluoromethyl)phenyl]- Chemical and Physical Properties
Names and Identifiers
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- 5-Thiazolecarboxylic acid,4-(hydroxymethyl)-2-[4-(trifluoromethyl)phenyl]-
- 5-Thiazolecarboxylic acid, 4-(hydroxymethyl)-2-[4-(trifluoromethyl)phenyl]-
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- Inchi： 1S/C12H8F3NO3S/c13-12(14,15)7-3-1-6(2-4-7)10-16-8(5-17)9(20-10)11(18)19/h1-4,17H,5H2,(H,18,19)
- InChI Key： SMFNULKKJXZXRG-UHFFFAOYSA-N
- SMILES： S1C(C(O)=O)=C(CO)N=C1C1=CC=C(C(F)(F)F)C=C1
Computed Properties
- Exact Mass: 303.01774
Experimental Properties
- Density: 1.537±0.06 g/cm3(Predicted)
- Boiling Point: 469.4±55.0 °C(Predicted)
- PSA: 70.42
- pka: 2.23±0.10(Predicted)
5-Thiazolecarboxylic acid,4-(hydroxymethyl)-2-[4-(trifluoromethyl)phenyl]- Related Literature
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
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