| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 13 | Yes |
Popular Name: 2-bromo-5-methoxy-4-methylbenzoic acid 2-bromo-5-methoxy-4-methylbenzoi…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 61809-40-3 , [61809-40-3]
| 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) | 2.68 | 0.47 | -47.81 | 0 | 3 | -1 | 49 | 244.064 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 189 - 191 | KeyOrganics |
| MP | 189-191° | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
