Cas no 133861-33-3 (2,6-Dibromo-3,5-bis(trifluoromethyl)aniline)
133861-33-3 structure
Product Name:2,6-Dibromo-3,5-bis(trifluoromethyl)aniline
CAS No:133861-33-3
MF:C8H3Br2F6N
MW:386.914541482925
CID:2625536
PubChem ID:4301401
Update Time:2025-04-21
2,6-Dibromo-3,5-bis(trifluoromethyl)aniline Chemical and Physical Properties
Names and Identifiers
-
- FFGIDWLBPMXQOY-UHFFFAOYSA-N
- 2,6-dibromo-3,5-bis(trifluoromethyl)aniline
- SCHEMBL6277666
- AKOS017344582
- 665-973-1
- 133861-33-3
- 2,6-Dibromo-3,5-bis(trifluoromethyl)aniline
-
- Inchi： 1S/C8H3Br2F6N/c9-4-2(7(11,12)13)1-3(8(14,15)16)5(10)6(4)17/h1H,17H2
- InChI Key： FFGIDWLBPMXQOY-UHFFFAOYSA-N
- SMILES： BrC1C(=C(C(C(F)(F)F)=CC=1C(F)(F)F)Br)N
Computed Properties
- Exact Mass: 386.85159Da
- Monoisotopic Mass: 384.85364Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 17
- Rotatable Bond Count: 0
- Complexity: 252
- 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: 4.4
- Topological Polar Surface Area: 26?2
2,6-Dibromo-3,5-bis(trifluoromethyl)aniline Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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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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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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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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