| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2004 | 14 | Yes |
Popular Name: Pentafluorobenzoic acid Pentafluorobenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 4830-57-3 , 602-94-8 , [602-94-8]
"2,3,4,5,6-Pentafluorobenzoic acid, 99%"
2,3,4,5,6-pentafluorobenzoic acid
2,3,4,5,6-Pentafluorobenzoic acid; Perfluorobenzoic acid
| 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) | 2.04 | 4.3 | -39.65 | 0 | 2 | -1 | 40 | 211.065 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 100 - 102 | Enamine Building Blocks |
| MP | 100-102° | Matrix Scientific |
| Melting_Point | 100-104? | Alfa-Aesar |
| Melting_Point | 100-104° | Alfa-Aesar |
| MP | 100...102 | Enamine Building Blocks |
| MP | 104 | TCI |
| mp | 105 - 106 | MolMall (formerly Molecular Diversity Preservation International) |
| Boiling_Point | 219-221? | Alfa-Aesar |
| Boiling_Point | 219-221° | Alfa-Aesar |
| BP | 220° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 99% | Matrix Scientific |
| Patent Database Links | EP0899256 | ChEBI |
| Warnings | IRRITANT | Matrix Scientific |
