Cas no 15053-71-1 (Benzonitrile,4,4'-[(2,3,5,6-tetrafluoro-1,4-phenylene)bis(oxy)]bis[2,3,5,6-tetrafluoro-)
15053-71-1 structure
Product Name:Benzonitrile,4,4'-[(2,3,5,6-tetrafluoro-1,4-phenylene)bis(oxy)]bis[2,3,5,6-tetrafluoro-
CAS No:15053-71-1
MF:C20F12N2O2
MW:528.207046508789
CID:211333
PubChem ID:297567
Update Time:2025-04-19
Benzonitrile,4,4'-[(2,3,5,6-tetrafluoro-1,4-phenylene)bis(oxy)]bis[2,3,5,6-tetrafluoro- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile,4,4'-[(2,3,5,6-tetrafluoro-1,4-phenylene)bis(oxy)]bis[2,3,5,6-tetrafluoro-
- 1,4-Bis-(4-cyan-2,3,5,6-tetrafluorphenoxy)-tetrafluorbenzol
- 1,4-bis(4'-cyano-2,3,5,6-tetrafluorophenoxytetrafluoro)benzene
- 4,4'-[(2,3,5,6-tetrafluorobenzene-1,4-diyl)bis(oxy)]bis(tetrafluorobenzonitrile)
- AC1L6RTG
- Benzonitrile,4'-[(2,3,5,6-tetrafluoro-1,4-phenylene)bis(oxy)]bis[2,3,5,6-tetrafluoro-
- NSC168750
- NSC-168750
- 15053-71-1
- DTXSID60305008
- 4,4'-[(2,3,5,6-Tetrafluoro-1,4-phenylene)bis(oxy)]bis(tetrafluorobenzonitrile)
-
- Inchi: 1S/C20F12N2O2/c21-5-3(1-33)6(22)10(26)17(9(5)25)35-19-13(29)15(31)20(16(32)14(19)30)36-18-11(27)7(23)4(2-34)8(24)12(18)28
- InChI Key: MPQRVCOHWIFRNA-UHFFFAOYSA-N
- SMILES: FC1C(=C(C(=C(C=1OC1C(=C(C(C#N)=C(C=1F)F)F)F)F)F)OC1C(=C(C(C#N)=C(C=1F)F)F)F)F
Computed Properties
- Exact Mass: 527.9768
- Monoisotopic Mass: 527.9768152g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 16
- Heavy Atom Count: 36
- Rotatable Bond Count: 4
- Complexity: 767
- 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: 5.6
- Topological Polar Surface Area: 66?2
Experimental Properties
- PSA: 66.04
Benzonitrile,4,4'-[(2,3,5,6-tetrafluoro-1,4-phenylene)bis(oxy)]bis[2,3,5,6-tetrafluoro- Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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