Cas no 927178-21-0 (Tert-Butyl 3-methyl-5-phenyl-1,2-oxazole-4-carboxylate)
927178-21-0 structure
Product Name:Tert-Butyl 3-methyl-5-phenyl-1,2-oxazole-4-carboxylate
CAS No:927178-21-0
MF:C15H17NO3
MW:259.300384283066
CID:735861
Update Time:2023-08-03
Tert-Butyl 3-methyl-5-phenyl-1,2-oxazole-4-carboxylate Chemical and Physical Properties
Names and Identifiers
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- 4-Isoxazolecarboxylic acid, 3-methyl-5-phenyl-, 1,1-dimethylethyl ester
- tert-butyl 3-methyl-5-phenyl-1,2-oxazole-4-carboxylate
- Tert-Butyl 3-methyl-5-phenyl-1,2-oxazole-4-carboxylate
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- Inchi： 1S/C15H17NO3/c1-10-12(14(17)18-15(2,3)4)13(19-16-10)11-8-6-5-7-9-11/h5-9H,1-4H3
- InChI Key： AZTPEIGJTKLSNC-UHFFFAOYSA-N
- SMILES： O(C(C1C(C)=NOC=1C1C=CC=CC=1)=O)C(C)(C)C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 318
- Topological Polar Surface Area: 52.3
Tert-Butyl 3-methyl-5-phenyl-1,2-oxazole-4-carboxylate Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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