| CAS Number | 1305917-51-4 |
| Catalog Number | AG01F8QV(AGN-PC-3H49BB) |
| Chemical Name | 2,2,2-Trifluoro-1-(2,4,6-trifluorophenyl)ethan-1-ol |
| IUPAC Name | 2,2,2-trifluoro-1-(2,4,6-trifluorophenyl)ethanol |
| InChI | InChI=1S/C8H4F6O/c9-3-1-4(10)6(5(11)2-3)7(15)8(12,13)14/h1-2,7,15H |
| InChI Key | BQWMNKFPOUZELU-UHFFFAOYSA-N |
| MDL Number | MFCD12787156 |
| Molecular Formula | C8H4F6O |
| Molecular Weight | 230.1072 |
| SMILES | Fc1cc(F)c(c(c1)F)C(C(F)(F)F)O |
| Synonyms | 2,2,2-Trifluoro-1-(2,4,6-trifluorophenyl)ethan-1-ol,
1305917-51-4,
|
| Complexity | 206 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.109g/mol |
| Monoisotopic Mass | 230.017g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number