Cas no 65537-87-3 (3,4,5-Tris(trifluoromethyl)bromobenzene)
65537-87-3 structure
Product Name:3,4,5-Tris(trifluoromethyl)bromobenzene
CAS No:65537-87-3
MF:C9H2BrF9
MW:361.001813411713
CID:2129682
PubChem ID:18349902
Update Time:2025-04-21
3,4,5-Tris(trifluoromethyl)bromobenzene Chemical and Physical Properties
Names and Identifiers
-
- 3,4,5-Tris(trifluoromethyl)bromobenzene
- SCHEMBL817540
- MFCD22581584
- NNSSUELHWFZSGL-UHFFFAOYSA-N
- DB-347778
- 65537-87-3
-
- Inchi： 1S/C9H2BrF9/c10-3-1-4(7(11,12)13)6(9(17,18)19)5(2-3)8(14,15)16/h1-2H
- InChI Key： NNSSUELHWFZSGL-UHFFFAOYSA-N
- SMILES： BrC1C=C(C(F)(F)F)C(C(F)(F)F)=C(C(F)(F)F)C=1
Computed Properties
- Exact Mass: 359.91962Da
- Monoisotopic Mass: 359.91962Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 19
- Rotatable Bond Count: 0
- Complexity: 291
- 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: 5.3
- Topological Polar Surface Area: 0?2
3,4,5-Tris(trifluoromethyl)bromobenzene Related Literature
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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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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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