Cas no 680215-14-9 (2-Propen-1-one, 1-(4-fluorophenyl)-3-[4-(trifluoromethyl)phenyl]-)
![2-Propen-1-one, 1-(4-fluorophenyl)-3-[4-(trifluoromethyl)phenyl]- structure](https://ossimg.kuujia.com/scimg/680500/680215-14-9x500.png)
680215-14-9 structure
Product Name:2-Propen-1-one, 1-(4-fluorophenyl)-3-[4-(trifluoromethyl)phenyl]-
CAS No:680215-14-9
MF:C16H10F4O
MW:294.243618488312
CID:393805
PubChem ID:2781339
Update Time:2025-04-19
2-Propen-1-one, 1-(4-fluorophenyl)-3-[4-(trifluoromethyl)phenyl]- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propen-1-one, 1-(4-fluorophenyl)-3-[4-(trifluoromethyl)phenyl]-
- 1-(4-fluorophenyl)-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-one
- AKOS030691951
- DTXSID20381787
- FLUPBLPNHLWRLJ-UHFFFAOYSA-N
- 680215-14-9
-
- Inchi： 1S/C16H10F4O/c17-14-8-4-12(5-9-14)15(21)10-3-11-1-6-13(7-2-11)16(18,19)20/h1-10H
- InChI Key： FLUPBLPNHLWRLJ-UHFFFAOYSA-N
- SMILES： FC(C1C=CC(C=CC(C2C=CC(=CC=2)F)=O)=CC=1)(F)F
Computed Properties
- Exact Mass: 294.0668
- Monoisotopic Mass: 294.06677759g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 21
- Rotatable Bond Count: 3
- Complexity: 372
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 4.1
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
2-Propen-1-one, 1-(4-fluorophenyl)-3-[4-(trifluoromethyl)phenyl]- Related Literature
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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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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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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