Cas no 223500-08-1 (2-Thiophenecarboxylic acid,5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-, ethyl ester)
![2-Thiophenecarboxylic acid,5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-, ethyl ester structure](https://ossimg.kuujia.com/scimg/224000/223500-08-1x500.png)
223500-08-1 structure
Product Name:2-Thiophenecarboxylic acid,5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-, ethyl ester
CAS No:223500-08-1
MF:C12H11F3N2O2S
MW:304.288151979446
CID:1407756
Update Time:2024-08-15
2-Thiophenecarboxylic acid,5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- 2-Thiophenecarboxylic acid,5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-, ethyl ester
- ethyl 5-(1-methyl-3-trifluoromethyl-1H-pyrazol-5-yl)-2-thiophenecarboxylate
- 2-Thiophenecarboxylic acid, 5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-, ethyl ester
-
- Inchi： 1S/C12H11F3N2O2S/c1-3-19-11(18)9-5-4-8(20-9)7-6-10(12(13,14)15)16-17(7)2/h4-6H,3H2,1-2H3
- InChI Key： VWIDOKBUYILSOK-UHFFFAOYSA-N
- SMILES： C1(C(OCC)=O)SC(C2N(C)N=C(C(F)(F)F)C=2)=CC=1
Computed Properties
- Exact Mass: 304.04943
Experimental Properties
- Density: 1.41±0.1 g/cm3(Predicted)
- Boiling Point: 390.2±42.0 °C(Predicted)
- PSA: 44.12
- pka: -1.30±0.10(Predicted)
2-Thiophenecarboxylic acid,5-[1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]-, ethyl ester Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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