Cas no 37135-30-1 (2-(4-Ethyl-2-fluorophenyl)-1,3-benzoxazole)
37135-30-1 structure
Product Name:2-(4-Ethyl-2-fluorophenyl)-1,3-benzoxazole
CAS No:37135-30-1
MF:C15H12FNO
MW:241.260287284851
CID:2824464
Update Time:2023-08-07
2-(4-Ethyl-2-fluorophenyl)-1,3-benzoxazole Chemical and Physical Properties
Names and Identifiers
-
- 2-(4-ethyl-2-fluorophenyl)benzoxazole
- 2-(4-ethyl-2-fluorophenyl) benzoxazole
- 2-(4-Ethyl-2-fluorophenyl)-1,3-benzoxazole
-
- Inchi： 1S/C15H12FNO/c1-2-10-7-8-11(12(16)9-10)15-17-13-5-3-4-6-14(13)18-15/h3-9H,2H2,1H3
- InChI Key： DCTFLNVNPBQXCA-UHFFFAOYSA-N
- SMILES： FC1C=C(C=CC=1C1=NC2C=CC=CC=2O1)CC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 286
- XLogP3: 4.3
- Topological Polar Surface Area: 26
2-(4-Ethyl-2-fluorophenyl)-1,3-benzoxazole Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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