Cas no 51655-76-6 (4-Oxazolecarboxylic acid, 2-(4-fluorophenyl)-5-methyl-, ethyl ester)
51655-76-6 structure
Product Name:4-Oxazolecarboxylic acid, 2-(4-fluorophenyl)-5-methyl-, ethyl ester
CAS No:51655-76-6
MF:C13H12FNO3
MW:249.237687110901
CID:361731
Update Time:2024-01-28
4-Oxazolecarboxylic acid, 2-(4-fluorophenyl)-5-methyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- 4-Oxazolecarboxylic acid, 2-(4-fluorophenyl)-5-methyl-, ethyl ester
- ethyl 2-(4-fluorophenyl)-5-methyl-1,3-oxazole-4-carboxylate
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- Inchi： 1S/C13H12FNO3/c1-3-17-13(16)11-8(2)18-12(15-11)9-4-6-10(14)7-5-9/h4-7H,3H2,1-2H3
- InChI Key： IZAQHUBRLSKBES-UHFFFAOYSA-N
- SMILES： O1C(C)=C(C(OCC)=O)N=C1C1=CC=C(F)C=C1
Computed Properties
- Exact Mass: 249.08016
Experimental Properties
- Density: 1.212±0.06 g/cm3(Predicted)
- Melting Point: 72-73 °C
- Boiling Point: 344.1±52.0 °C(Predicted)
- PSA: 52.33
- pka: -1.33±0.10(Predicted)
4-Oxazolecarboxylic acid, 2-(4-fluorophenyl)-5-methyl-, ethyl ester Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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4. 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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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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