| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 11 | Yes |
Popular Name: 2-Bromo-6-chlorobenzoic acid 2-Bromo-6-chlorobenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 93224-85-2 , [93224-85-2]
| 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) | 2.90 | -0.28 | -51.11 | 0 | 2 | -1 | 40 | 234.456 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 141 - 143 | MolMall (formerly Molecular Diversity Preservation International) |
| Melting_Point | 148-150? | Alfa-Aesar |
| MP | 148-150° | Matrix Scientific |
| Purity | 95% | Fluorochem |
| Purity | 98% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | WO2000001692A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.