Cas no 1493-11-4 (Methanol, trifluoro-(6CI,8CI,9CI))
1493-11-4 structure
Product Name:Methanol, trifluoro-(6CI,8CI,9CI)
Methanol, trifluoro-(6CI,8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- Methanol, trifluoro-(6CI,8CI,9CI)
- trifluoromethanol
- AC1L2KQV
- AC1Q4KDB
- AG-D-95378
- AR-1L7373
- CTK4C6130
- Methanol, trifluoro-
- Perfluoromethanol
- perfluoro-tert-butyl alcohol
- Trifluor-methanol
- trifluoroethanol
- Trifluoromethyl alcohol
- Q2453107
- DTXSID00164217
- WZCZNEGTXVXAAS-UHFFFAOYSA-N
- 1493-11-4
-
- Inchi： 1S/CHF3O/c2-1(3,4)5/h5H
- InChI Key： WZCZNEGTXVXAAS-UHFFFAOYSA-N
- SMILES： FC(O)(F)F
Computed Properties
- Exact Mass: 85.99793
- Monoisotopic Mass: 85.998
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 5
- Rotatable Bond Count: 0
- Complexity: 28.4
- 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: 20.2A^2
- XLogP3: 0.8
Experimental Properties
- Density: 1.459
- Boiling Point: 22.4°Cat760mmHg
- Flash Point: 18.9°C
- Refractive Index: 1.231
- PSA: 20.23
Methanol, trifluoro-(6CI,8CI,9CI) Related Literature
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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