Cas no 51431-75-5 (Benzene,1,3,5-trimethyl-2-[[4-(trifluoromethyl)phenyl]thio]-)
![Benzene,1,3,5-trimethyl-2-[[4-(trifluoromethyl)phenyl]thio]- structure](https://ossimg.kuujia.com/scimg/51500/51431-75-5x500.png)
51431-75-5 structure
Product Name:Benzene,1,3,5-trimethyl-2-[[4-(trifluoromethyl)phenyl]thio]-
CAS No:51431-75-5
MF:C16H15F3S
MW:296.350513696671
CID:379092
PubChem ID:345606
Update Time:2025-04-19
Benzene,1,3,5-trimethyl-2-[[4-(trifluoromethyl)phenyl]thio]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1,3,5-trimethyl-2-[[4-(trifluoromethyl)phenyl]thio]-
- 1,3,5-trimethyl-2-[4-(trifluoromethyl)phenyl]sulfanylbenzene
- NSC403312
- NSC-403312
- 51431-75-5
- DTXSID80323188
-
- Inchi： 1S/C16H15F3S/c1-10-8-11(2)15(12(3)9-10)20-14-6-4-13(5-7-14)16(17,18)19/h4-9H,1-3H3
- InChI Key： LSSRWXVDMDSZTH-UHFFFAOYSA-N
- SMILES： S(C1C=CC(C(F)(F)F)=CC=1)C1C(C)=CC(C)=CC=1C
Computed Properties
- Exact Mass: 296.08475
- Monoisotopic Mass: 296.08465614g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 295
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 6
- Topological Polar Surface Area: 25.3?2
Experimental Properties
- PSA: 0
Benzene,1,3,5-trimethyl-2-[[4-(trifluoromethyl)phenyl]thio]- Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
-
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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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
51431-75-5 (Benzene,1,3,5-trimethyl-2-[[4-(trifluoromethyl)phenyl]thio]-) Related Products
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