Cas no 725743-44-2 (Ethanone, 2-bromo-1-[5-bromo-2-(trifluoromethoxy)phenyl]-)
725743-44-2 structure
Product Name:Ethanone, 2-bromo-1-[5-bromo-2-(trifluoromethoxy)phenyl]-
CAS No:725743-44-2
MF:C9H5Br2F3O2
MW:361.938011884689
CID:4159011
PubChem ID:85981110
Update Time:2025-04-24
Ethanone, 2-bromo-1-[5-bromo-2-(trifluoromethoxy)phenyl]- Chemical and Physical Properties
Names and Identifiers
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- Ethanone, 2-bromo-1-[5-bromo-2-(trifluoromethoxy)phenyl]-
- Bromo-1-(5-bromo-2-trifluoromethoxy-phenyl)-ethanone
- 725743-44-2
- SCHEMBL3925476
- 5'-Bromo-2'-(trifluoromethoxy)phenacyl bromide
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- Inchi: 1S/C9H5Br2F3O2/c10-4-7(15)6-3-5(11)1-2-8(6)16-9(12,13)14/h1-3H,4H2
- InChI Key: WUELJQGZKKGLMI-UHFFFAOYSA-N
- SMILES: C(=O)(C1=CC(Br)=CC=C1OC(F)(F)F)CBr
Computed Properties
- Exact Mass: 361.85879Da
- Monoisotopic Mass: 359.86084Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 258
- 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: 4.3
- Topological Polar Surface Area: 26.3?2
Ethanone, 2-bromo-1-[5-bromo-2-(trifluoromethoxy)phenyl]- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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