Cas no 833447-95-3 (Benzenemethanol, 2,4,6-tris(trifluoromethyl)-)
833447-95-3 structure
Product Name:Benzenemethanol, 2,4,6-tris(trifluoromethyl)-
CAS No:833447-95-3
MF:C10H5F9O
MW:312.131734609604
CID:673392
PubChem ID:71415638
Update Time:2025-04-19
Benzenemethanol, 2,4,6-tris(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol, 2,4,6-tris(trifluoromethyl)-
- [2,4,6-tris(trifluoromethyl)phenyl]methanol
- SCHEMBL21490263
- DTXSID30835049
- 833447-95-3
-
- Inchi： 1S/C10H5F9O/c11-8(12,13)4-1-6(9(14,15)16)5(3-20)7(2-4)10(17,18)19/h1-2,20H,3H2
- InChI Key： NVMWRUNYOVGWKD-UHFFFAOYSA-N
- SMILES： FC(C1C=C(C(F)(F)F)C=C(C(F)(F)F)C=1CO)(F)F
Computed Properties
- Exact Mass: 312.01966824g/mol
- Monoisotopic Mass: 312.01966824g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 10
- Heavy Atom Count: 20
- Rotatable Bond Count: 1
- Complexity: 305
- 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: 3.7
- Topological Polar Surface Area: 20.2?2
Benzenemethanol, 2,4,6-tris(trifluoromethyl)- Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
833447-95-3 (Benzenemethanol, 2,4,6-tris(trifluoromethyl)-) Related Products
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