Cas no 916336-47-5 (Borane, tris[2,4,6-tris(trifluoromethyl)phenyl]-)
916336-47-5 structure
Product Name:Borane, tris[2,4,6-tris(trifluoromethyl)phenyl]-
CAS No:916336-47-5
MF:C27H6BF27
MW:854.104442119598
CID:786863
PubChem ID:71428746
Update Time:2025-04-19
Borane, tris[2,4,6-tris(trifluoromethyl)phenyl]- Chemical and Physical Properties
Names and Identifiers
-
- Borane, tris[2,4,6-tris(trifluoromethyl)phenyl]-
- tris[2,4,6-tris(trifluoromethyl)phenyl]borane
- tris[2,4,6-tris(trifluoromethyl)phenyl] borane
- DTXSID10847463
- ZSOIGXOJCZHDIT-UHFFFAOYSA-N
- 916336-47-5
-
- Inchi: 1S/C27H6BF27/c29-19(30,31)7-1-10(22(38,39)40)16(11(2-7)23(41,42)43)28(17-12(24(44,45)46)3-8(20(32,33)34)4-13(17)25(47,48)49)18-14(26(50,51)52)5-9(21(35,36)37)6-15(18)27(53,54)55/h1-6H
- InChI Key: ZSOIGXOJCZHDIT-UHFFFAOYSA-N
- SMILES: FC(C1C=C(C(F)(F)F)C=C(C(F)(F)F)C=1B(C1C(C(F)(F)F)=CC(C(F)(F)F)=CC=1C(F)(F)F)C1C(C(F)(F)F)=CC(C(F)(F)F)=CC=1C(F)(F)F)(F)F
Computed Properties
- Exact Mass: 854.0131407g/mol
- Monoisotopic Mass: 854.0131407g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 27
- Heavy Atom Count: 55
- Rotatable Bond Count: 3
- Complexity: 1060
- 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
- Topological Polar Surface Area: 0?2
Borane, tris[2,4,6-tris(trifluoromethyl)phenyl]- Related Literature
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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