Cas no 235101-50-5 (2-Iodo-3-(trifluoromethoxy)aniline)
235101-50-5 structure
Product Name:2-Iodo-3-(trifluoromethoxy)aniline
CAS No:235101-50-5
MF:C7H5F3INO
MW:303.020384550095
CID:4711618
Update Time:2023-08-16
2-Iodo-3-(trifluoromethoxy)aniline Chemical and Physical Properties
Names and Identifiers
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- 2-iodo-3-(trifluoromethoxy)aniline
- 2-Iodo-3-(trifluoromethoxy)aniline
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- Inchi： 1S/C7H5F3INO/c8-7(9,10)13-5-3-1-2-4(12)6(5)11/h1-3H,12H2
- InChI Key： SENDGUDSUCGOJN-UHFFFAOYSA-N
- SMILES： IC1C(=CC=CC=1OC(F)(F)F)N
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 176
- Topological Polar Surface Area: 35.2
2-Iodo-3-(trifluoromethoxy)aniline Related Literature
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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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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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