Cas no 920269-80-3 (2-Fluoro-4'-octyl[1,1'-biphenyl]-4-carboxylic acid)
920269-80-3 structure
Product Name:2-Fluoro-4'-octyl[1,1'-biphenyl]-4-carboxylic acid
CAS No:920269-80-3
MF:C21H25FO2
MW:328.420409917831
CID:758890
Update Time:2023-08-03
2-Fluoro-4'-octyl[1,1'-biphenyl]-4-carboxylic acid Chemical and Physical Properties
Names and Identifiers
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- [1,1'-Biphenyl]-4-carboxylic acid, 2-fluoro-4'-octyl-
- 3-fluoro-4-(4-octylphenyl)benzoic acid
- BDBM50413263
- 2-Fluoro-4'-octyl[1,1'-biphenyl]-4-carboxylic acid
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- Inchi: 1S/C21H25FO2/c1-2-3-4-5-6-7-8-16-9-11-17(12-10-16)19-14-13-18(21(23)24)15-20(19)22/h9-15H,2-8H2,1H3,(H,23,24)
- InChI Key: WJSJHHUQCNPEPK-UHFFFAOYSA-N
- SMILES: FC1C=C(C(=O)O)C=CC=1C1C=CC(=CC=1)CCCCCCCC
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 24
- Rotatable Bond Count: 9
- Complexity: 363
- Topological Polar Surface Area: 37.3
2-Fluoro-4'-octyl[1,1'-biphenyl]-4-carboxylic acid Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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