| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2005 | 12 | Yes |
Popular Name: 3-Bromo-4-methoxybenzoic acid 3-Bromo-4-methoxybenzoic acid
3-Bromo-4-Methoxybenzoic Acid [99-58-1]; (3-Bromo-p-anisic acid)
3-Bromo-4-methoxybenzoic acid, 98+%
3-BROMO-4-METHOXYBENZOIC ACID; [99-58-1]
| 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) | 2.64 | 0.13 | -47.28 | 0 | 3 | -1 | 49 | 230.037 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.67 | 10.91 | -6.57 | 0 | 2 | 0 | 22 | 291.822 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 216-217° | Matrix Scientific |
| MP | 217-218° | Oakwood Chemical |
| Melting_Point | 217-222? | Alfa-Aesar |
| Melting_Point | 217-222° | Alfa-Aesar |
| MP | 220-222 °C(lit.) | Indofine |
| MP | 220-222o C | Indofine |
| MP | 222 | TCI |
| Purity | 95% | Fluorochem |
| Purity | 98% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| SOLUBILITY | Soluble in Ethyl acetate | Indofine |
No pre-computed analogs available. Try a structural similarity search.