| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 20 | No |
Popular Name: Hexafluoroisopropyl tosylate Hexafluoroisopropyl tosylate
Find On: PubMed — Wikipedia — Google
CAS Number: 67674-48-0
1,1,1,3,3,3-Hexafluoroisopropyl 4-toluenesulphonate
1,1,1,3,3,3-Hexafluoroisopropyl 4-toluenesulphonate 97%
1,1,1,3,3,3-Hexafluoroisopropyl p-toluenesulfonate
1,1,1,3,3,3-Hexafluoroisopropyl p-toluenesulfonate, 97%
Hexafluoroisopropyl-4-Toluenesulfonate
p-Toluenesulfonic acid 1,1,1,3,3,3-hexafluoroisopropyl ester
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.49 | 1.06 | -7.96 | 0 | 3 | 0 | 43 | 322.226 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 134 / 22.5 | TCI |
| Melting_Point | 39-40? | Alfa-Aesar |
| Melting_Point | 39-40° | Alfa-Aesar |
| MP | 45 | TCI |
| Purity | 97% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | US5716756 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.