| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 13 | Yes |
Popular Name: Isopropyl 4-hydroxybenzoate Isopropyl 4-hydroxybenzoate
4-Hydroxybenzoic acid isopropyl ester
4191-73-5; C20343; Isopropyl 4-hydroxybenzoate; Isopropylparaben
benzoic acid, 4-hydroxy-, 1-methylethyl ester
Isopropyl 4-Hydroxybenzoate [for Biochemical Research]
| 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) | 2.37 | 0.62 | -6.76 | 1 | 3 | 0 | 47 | 180.203 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 160 / 5 | TCI |
| MP | 82 - 86 | Enamine Building Blocks |
| MP | 83 - 85 | Enamine Building Blocks |
| MP | 83...85 | Enamine Building Blocks |
| Melting_Point | 84-86? | Alfa-Aesar |
| Melting_Point | 84-86° | Alfa-Aesar |
| MP | 86 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
