Cas no 62772-89-8 (Pyrimidine, 4-ethyl-2-methoxy-6-(trifluoromethyl)-)
62772-89-8 structure
Product Name:Pyrimidine, 4-ethyl-2-methoxy-6-(trifluoromethyl)-
CAS No:62772-89-8
MF:C8H9F3N2O
MW:206.165072202682
CID:431766
PubChem ID:12324822
Update Time:2025-04-19
Pyrimidine, 4-ethyl-2-methoxy-6-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine, 4-ethyl-2-methoxy-6-(trifluoromethyl)-
- 4-ethyl-2-methoxy-6-(trifluoromethyl)pyrimidine
- 62772-89-8
- DTXSID80489258
-
- Inchi： 1S/C8H9F3N2O/c1-3-5-4-6(8(9,10)11)13-7(12-5)14-2/h4H,3H2,1-2H3
- InChI Key： TZCDCDGTHUZGSR-UHFFFAOYSA-N
- SMILES： FC(C1=CC(CC)=NC(=N1)OC)(F)F
Computed Properties
- Exact Mass: 206.06677
- Monoisotopic Mass: 206.06669740g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 186
- 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: 2.3
- Topological Polar Surface Area: 35?2
Experimental Properties
- PSA: 35.01
Pyrimidine, 4-ethyl-2-methoxy-6-(trifluoromethyl)- Related Literature
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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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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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
62772-89-8 (Pyrimidine, 4-ethyl-2-methoxy-6-(trifluoromethyl)-) Related Products
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