Cas no 922718-48-7 (1,1'-[Heptane-1,7-diylbis(oxy)]bis(2,3,4-trifluorobenzene))
922718-48-7 structure
Product Name:1,1'-[Heptane-1,7-diylbis(oxy)]bis(2,3,4-trifluorobenzene)
CAS No:922718-48-7
MF:C19H18F6O2
MW:392.335446834564
CID:739560
Update Time:2023-08-03
1,1'-[Heptane-1,7-diylbis(oxy)]bis(2,3,4-trifluorobenzene) Chemical and Physical Properties
Names and Identifiers
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- Benzene, 1,1'-[1,7-heptanediylbis(oxy)]bis[2,3,4-trifluoro-
- 1,2,3-trifluoro-4-[7-(2,3,4-trifluorophenoxy)heptoxy]benzene
- 4,4'-(1,7-Heptanediylbisoxy)bis(1,2,3-trifluorobenzene)
- 1,1'-[Heptane-1,7-diylbis(oxy)]bis(2,3,4-trifluorobenzene)
-
- Inchi: 1S/C19H18F6O2/c20-12-6-8-14(18(24)16(12)22)26-10-4-2-1-3-5-11-27-15-9-7-13(21)17(23)19(15)25/h6-9H,1-5,10-11H2
- InChI Key: ZCJIRZZRULEABH-UHFFFAOYSA-N
- SMILES: FC1C(=C(C=CC=1OCCCCCCCOC1C=CC(=C(C=1F)F)F)F)F
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 27
- Rotatable Bond Count: 10
- Complexity: 380
- Topological Polar Surface Area: 18.5
1,1'-[Heptane-1,7-diylbis(oxy)]bis(2,3,4-trifluorobenzene) Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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