AC1LDHS7
1-(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)oxy-5-methyl-3,3-bis(trifluoromethyl)-1λ3,2-benziodoxole
Also Known As: 1,2-Benziodoxole, 1,3-dihydro-5-methyl-3,3-bis(trifluoromethyl)-1-[2,2,2-trifluoro-1-phenyl-1-(trifluoromethyl)ethoxy]-|1-(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)oxy-5-methyl-3,3-bis(trifluoromethyl)-1|1,2-Benziodoxole, 1,3-dihydro-5-methyl-3,3-bis(trifluoromethyl)-1-(2,2,2-trifluoro-1-phenyl-1-(trifluoromethyl)ethoxy)-|1,3-Dihydro-5-methyl-1-(1-phenyl-1-(trifluoromethyl)-2,2,2-trifluoroethoxy)-3,3-bis(trifluoromethyl))-1,2-benziodoxole|1,3-Dihydro-5-methyl-1-[1-phenyl-1-(trifluoromethyl)-2,2,2-trifluoroethoxy]-3,3-bis(trifluoromethyl)-1,2-benziodoxole|1-[(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)oxy]-5-methyl-3,3-bis(trifluoromethyl)-3H-1lambda3,2-benziodaoxole
| Molecular Formula | C19H11F12IO2 |
|---|---|
| Molecular Weight | 625.96124 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 3 |
| Exact Mass | 625.96124 |
| Monoisotopic Mass | 625.96124 |
| Heavy Atoms | 34 |
| Complexity | 695.0 |
Chemical Identifiers
| CAS Number | 69352-06-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)I(OC2(C(F)(F)F)C(F)(F)F)OC(C3=CC=CC=C3)(C(F)(F)F)C(F)(F)F |
| InChIKey | DUUFXDAMBGNFIR-UHFFFAOYSA-N |
Product Overview
AC1LDHS7 (CAS 69352-06-3), with molecular formula C19H11F12IO2 and molecular weight 625.96124 g/mol. IUPAC: 1-(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)oxy-5-methyl-3,3-bis(trifluoromethyl)-1λ3,2-benziodoxole.