Cas no 57478-14-5 (Benzenamine, 4-[2-(trifluoromethyl)phenoxy]-, hydrochloride)
![Benzenamine, 4-[2-(trifluoromethyl)phenoxy]-, hydrochloride structure](https://ossimg.kuujia.com/scimg/57500/57478-14-5x500.png)
57478-14-5 structure
Product Name:Benzenamine, 4-[2-(trifluoromethyl)phenoxy]-, hydrochloride
CAS No:57478-14-5
MF:C13H11ClF3NO
MW:289.68075299263
CID:345139
PubChem ID:71444102
Update Time:2025-04-19
Benzenamine, 4-[2-(trifluoromethyl)phenoxy]-, hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- 4-[2-(trifluoromethyl)phenoxy]aniline,hydrochloride
- Benzenamine, 4-[2-(trifluoromethyl)phenoxy]-, hydrochloride
- 57478-14-5
- 4-[2-(Trifluoromethyl)phenoxy]aniline--hydrogen chloride (1/1)
- DTXSID60852901
-
- Inchi： 1S/C13H10F3NO.ClH/c14-13(15,16)11-3-1-2-4-12(11)18-10-7-5-9(17)6-8-10;/h1-8H,17H2;1H
- InChI Key： KBISJGMYTODVEY-UHFFFAOYSA-N
- SMILES： Cl.FC(C1C=CC=CC=1OC1C=CC(=CC=1)N)(F)F
Computed Properties
- Exact Mass: 289.04823
- Monoisotopic Mass: 289.0481262g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 262
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 35.2?2
Experimental Properties
- PSA: 35.25
Benzenamine, 4-[2-(trifluoromethyl)phenoxy]-, hydrochloride Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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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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