Cas no 847900-75-8 (Quinoline, 5-bromo-2-chloro-4-(trifluoromethyl)-)
847900-75-8 structure
Product Name:Quinoline, 5-bromo-2-chloro-4-(trifluoromethyl)-
CAS No:847900-75-8
MF:C10H4BrClF3N
MW:310.497671127319
CID:4219785
PubChem ID:83400964
Update Time:2025-04-24
Quinoline, 5-bromo-2-chloro-4-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
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- Quinoline, 5-bromo-2-chloro-4-(trifluoromethyl)-
- 5-BROMO-2-CHLORO-4-TRIFLUOROMETHYL-QUINOLINE
- 847900-75-8
-
- Inchi: 1S/C10H4BrClF3N/c11-6-2-1-3-7-9(6)5(10(13,14)15)4-8(12)16-7/h1-4H
- InChI Key: OEFSHEJCWCOVBS-UHFFFAOYSA-N
- SMILES: N1C2C(=C(Br)C=CC=2)C(C(F)(F)F)=CC=1Cl
Computed Properties
- Exact Mass: 308.91677Da
- Monoisotopic Mass: 308.91677Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 261
- 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: 4.7
- Topological Polar Surface Area: 12.9?2
Quinoline, 5-bromo-2-chloro-4-(trifluoromethyl)- Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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