AC1L4JQD
1-methyl-4-(1,1,2,2,2-pentafluoroethyl)-2,6,7-trioxabicyclo[2.2.2]octane
Also Known As: 5-19-09-00133 (Beilstein Handbook Reference)|Orthopropionic acid, pentafluoro-, cyclic ester with 2-(hydroxymethyl)-2-methyl-1,3-propanediol (1:1)|1-methyl-4-(pentafluoroethyl)-2,6,7-trioxabicyclo[2.2.2]octane|Pentafluoroorthopropionic acid cyclic ester with 2-(hydroxymethyl)-2-methyl-1,3-propanediol|1-methyl-4-(1,1,2,2,2-pentafluoroethyl)-2,6,7-trioxabicyclo[2.2.2]octane
| Molecular Formula | C8H9F5O3 |
|---|---|
| Molecular Weight | 248.04718 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.04718 |
| Monoisotopic Mass | 248.04718 |
| Heavy Atoms | 16 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 5465-83-8 |
|---|---|
| SMILES | CC12OCC(CO1)(CO2)C(C(F)(F)F)(F)F |
| InChIKey | ZTZBZLHRPLUMJK-UHFFFAOYSA-N |
Product Overview
AC1L4JQD (CAS 5465-83-8), with molecular formula C8H9F5O3 and molecular weight 248.04718 g/mol. IUPAC: 1-methyl-4-(1,1,2,2,2-pentafluoroethyl)-2,6,7-trioxabicyclo[2.2.2]octane.
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