Cas no 825633-79-2 (1,1':4',1''-Terphenyl, 4''-ethyl-2',2'',4-trifluoro-)
825633-79-2 structure
Product Name:1,1':4',1''-Terphenyl, 4''-ethyl-2',2'',4-trifluoro-
CAS No:825633-79-2
MF:C20H15F3
MW:312.328315973282
CID:688168
PubChem ID:71418089
Update Time:2025-04-19
1,1':4',1''-Terphenyl, 4''-ethyl-2',2'',4-trifluoro- Chemical and Physical Properties
Names and Identifiers
-
- 1,1':4',1''-Terphenyl, 4''-ethyl-2',2'',4-trifluoro-
- 4-ethyl-2-fluoro-1-[3-fluoro-4-(4-fluorophenyl)phenyl]benzene
- 1~4~-Ethyl-1~2~,2~3~,3~4~-trifluoro-1~1~,2~1~:2~4~,3~1~-terphenyl
- DTXSID80837417
- 825633-79-2
-
- Inchi： 1S/C20H15F3/c1-2-13-3-9-18(19(22)11-13)15-6-10-17(20(23)12-15)14-4-7-16(21)8-5-14/h3-12H,2H2,1H3
- InChI Key： BQSAWFPSTQIVLY-UHFFFAOYSA-N
- SMILES： FC1C=C(C=CC=1C1C=CC(C2C=CC(=CC=2)F)=C(C=1)F)CC
Computed Properties
- Exact Mass: 312.11258496g/mol
- Monoisotopic Mass: 312.11258496g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 23
- Rotatable Bond Count: 3
- Complexity: 364
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 6.3
- Topological Polar Surface Area: 0?2
1,1':4',1''-Terphenyl, 4''-ethyl-2',2'',4-trifluoro- Related Literature
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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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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Yuan-Jun Tong,Lu-Dan Yu,Lu-Lu Wu,Shu-Ping Cao,Ru-Ping Liang,Li Zhang,Xing-Hua Xia,Jian-Ding Qiu Chem. Commun., 2018,54, 7487-7490
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Xiao Liu,Jun Xu,Yinyun Lv,Wenyu Wu,Weisheng Liu,Yu Tang Dalton Trans., 2013,42, 9840-9846
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