Cas no 1257266-94-6 (Ethyl 2-ethyloxazole-5-carboxylate)
1257266-94-6 structure
Product Name:Ethyl 2-ethyloxazole-5-carboxylate
CAS No:1257266-94-6
MF:C8H11NO3
MW:169.177842378616
CID:2126147
Update Time:2023-08-04
Ethyl 2-ethyloxazole-5-carboxylate Chemical and Physical Properties
Names and Identifiers
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- ethyl 2-ethyloxazole-5-carboxylate
- CIWFKCUZQXHNKW-UHFFFAOYSA-N
- Ethyl 2-ethyloxazole-5-carboxylate
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- Inchi： 1S/C8H11NO3/c1-3-7-9-5-6(12-7)8(10)11-4-2/h5H,3-4H2,1-2H3
- InChI Key： CIWFKCUZQXHNKW-UHFFFAOYSA-N
- SMILES： O1C(C(=O)OCC)=CN=C1CC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 160
- Topological Polar Surface Area: 52.3
Ethyl 2-ethyloxazole-5-carboxylate Related Literature
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Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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3. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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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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