Cas no 726136-61-4 ([1,1'-Biphenyl]-4-carboxaldehyde, 2-methyl-2'-(trifluoromethyl)-)
726136-61-4 structure
Product Name:[1,1'-Biphenyl]-4-carboxaldehyde, 2-methyl-2'-(trifluoromethyl)-
CAS No:726136-61-4
MF:C15H11F3O
MW:264.242454767227
CID:1756324
PubChem ID:58609648
Update Time:2025-04-21
[1,1'-Biphenyl]-4-carboxaldehyde, 2-methyl-2'-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- [1,1'-Biphenyl]-4-carboxaldehyde, 2-methyl-2'-(trifluoromethyl)-
- 2-Methyl-2a(2)-(trifluoromethyl)[1,1a(2)-biphenyl]-4-carboxaldehyde
- (2-methyl-2'-trifluoromethyl-[1,1'-biphenyl]-4-yl]methanone
- 2-Methyl-2'-(trifluoromethyl)-[1,1'-biphenyl]-4-carboxaldehyde
- AKOS020025394
- SCHEMBL5964273
- DTXSID301183426
- 726136-61-4
-
- Inchi: 1S/C15H11F3O/c1-10-8-11(9-19)6-7-12(10)13-4-2-3-5-14(13)15(16,17)18/h2-9H,1H3
- InChI Key: KNWLRBCQTDOTPE-UHFFFAOYSA-N
- SMILES: FC(C1C=CC=CC=1C1C=CC(C=O)=CC=1C)(F)F
Computed Properties
- Exact Mass: 264.07619946g/mol
- Monoisotopic Mass: 264.07619946g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 313
- 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: 4.3
- Topological Polar Surface Area: 17.1?2
[1,1'-Biphenyl]-4-carboxaldehyde, 2-methyl-2'-(trifluoromethyl)- Related Literature
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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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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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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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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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