| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2006 | 16 | Yes |
Popular Name: 3-Bromo-4-(isopentyloxy)benzoic acid 3-Bromo-4-(isopentyloxy)benzoic …
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CAS Numbers: , 881596-09-4 , [881596-09-4]
3-bromo-4-(3-methylbutoxy)benzoic acid
3-Bromo-4-(isopentyloxy)benzoicacid
| 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) | 4.29 | 0.66 | -46.16 | 0 | 3 | -1 | 49 | 286.145 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
