Cas no 1960-92-5 (Methyl-3-(3-fluorophenyl)-5-methylisoxazol-4-carboxylate)
1960-92-5 structure
Product Name:Methyl-3-(3-fluorophenyl)-5-methylisoxazol-4-carboxylate
CAS No:1960-92-5
MF:C12H10FNO3
MW:235.211106777191
CID:4770067
Update Time:2023-08-16
Methyl-3-(3-fluorophenyl)-5-methylisoxazol-4-carboxylate Chemical and Physical Properties
Names and Identifiers
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- methyl-3-(3-fluorophenyl)-5-methylisoxazol-4-carboxylate
- Methyl 3-(3-fluorophenyl)-5-methylisoxazole-4-carboxylate
- methyl 3-(3-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxylate
- Methyl-3-(3-fluorophenyl)-5-methylisoxazol-4-carboxylate
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- Inchi： 1S/C12H10FNO3/c1-7-10(12(15)16-2)11(14-17-7)8-4-3-5-9(13)6-8/h3-6H,1-2H3
- InChI Key： OOSIJFGXSOANPS-UHFFFAOYSA-N
- SMILES： FC1=CC=CC(=C1)C1C(C(=O)OC)=C(C)ON=1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 287
- XLogP3: 2.4
- Topological Polar Surface Area: 52.3
Methyl-3-(3-fluorophenyl)-5-methylisoxazol-4-carboxylate Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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