Cas no 1214370-66-7 (2-(Trifluoromethyl)biphenyl-3-carboxylic acid)
1214370-66-7 structure
Product Name:2-(Trifluoromethyl)biphenyl-3-carboxylic acid
CAS No:1214370-66-7
MF:C14H9F3O2
MW:266.215274572372
CID:2161255
Update Time:2023-08-05
2-(Trifluoromethyl)biphenyl-3-carboxylic acid Chemical and Physical Properties
Names and Identifiers
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- 2-(Trifluoromethyl)biphenyl-3-carboxylic acid
-
- Inchi： 1S/C14H9F3O2/c15-14(16,17)12-10(9-5-2-1-3-6-9)7-4-8-11(12)13(18)19/h1-8H,(H,18,19)
- InChI Key： HFMANPWDMFQZEB-UHFFFAOYSA-N
- SMILES： FC(C1C(C(=O)O)=CC=CC=1C1C=CC=CC=1)(F)F
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 321
- XLogP3: 3.8
- Topological Polar Surface Area: 37.3
2-(Trifluoromethyl)biphenyl-3-carboxylic acid Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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