Cas no 72850-80-7 (Ethyl 2-fluoro-4-(trifluoromethyl)thiazole-5-carboxylate)
72850-80-7 structure
Product Name:Ethyl 2-fluoro-4-(trifluoromethyl)thiazole-5-carboxylate
CAS No:72850-80-7
MF:C7H5F4NO2S
MW:243.178714513779
CID:977596
Update Time:2023-08-02
Ethyl 2-fluoro-4-(trifluoromethyl)thiazole-5-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- 5-Thiazolecarboxylicacid,2-fluoro-4-(trifluoromethyl)-,ethylester(9CI)
- ethyl 2-fluoro-4-(trifluoromethyl)thiazole-5-carboxylate
- GOWNRNPFIKSLAT-UHFFFAOYSA-N
- Ethyl 2-Fluoro-4-Trifluoromethyl-5-Thiazolecarboxylate
- ethyl 2-fluoro-4-(trifluoromethyl)-5-thiazolecarboxylate
- Ethyl 2-fluoro-4-(trifluoromethyl)thiazole-5-carboxylate
-
- Inchi： 1S/C7H5F4NO2S/c1-2-14-5(13)3-4(7(9,10)11)12-6(8)15-3/h2H2,1H3
- InChI Key： GOWNRNPFIKSLAT-UHFFFAOYSA-N
- SMILES： S1C(=NC(C(F)(F)F)=C1C(=O)OCC)F
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 248
- Topological Polar Surface Area: 67.4
Ethyl 2-fluoro-4-(trifluoromethyl)thiazole-5-carboxylate Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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