Cas no 87908-64-3 (Cyclohexanone, 2-[4-(trifluoromethyl)benzoyl]-)
![Cyclohexanone, 2-[4-(trifluoromethyl)benzoyl]- structure](https://ossimg.kuujia.com/scimg/88000/87908-64-3x500.png)
87908-64-3 structure
Product Name:Cyclohexanone, 2-[4-(trifluoromethyl)benzoyl]-
CAS No:87908-64-3
MF:C14H13F3O2
MW:270.247034788132
CID:650776
PubChem ID:20211899
Update Time:2025-04-19
Cyclohexanone, 2-[4-(trifluoromethyl)benzoyl]- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanone, 2-[4-(trifluoromethyl)benzoyl]-
- 2-[4-(trifluoromethyl)benzoyl]cyclohexan-1-one
- DTXSID60603632
- 2-[4-(trifluoromethyl)benzoyl]cyclohexanone
- 87908-64-3
- SCHEMBL10740705
-
- Inchi： 1S/C14H13F3O2/c15-14(16,17)10-7-5-9(6-8-10)13(19)11-3-1-2-4-12(11)18/h5-8,11H,1-4H2
- InChI Key： QOOGSUPXWRVDSF-UHFFFAOYSA-N
- SMILES： FC(C1C=CC(=CC=1)C(C1C(CCCC1)=O)=O)(F)F
Computed Properties
- Exact Mass: 270.08676414g/mol
- Monoisotopic Mass: 270.08676414g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 354
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.4
- Topological Polar Surface Area: 34.1?2
Cyclohexanone, 2-[4-(trifluoromethyl)benzoyl]- Related Literature
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L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
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Rongyan Guo,Tao Li,Shuie Shi J. Mater. Chem. C, 2019,7, 5148-5154
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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