| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2008 | 13 | Yes |
Popular Name: Ethyl 5-bromo-2-methylbenzoate Ethyl 5-bromo-2-methylbenzoate
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CAS Number: 359629-91-7
Ethyl 2-methyl-5-bromobenzoate [5-bromo-2-methylbenzoic acid ethyle ester]
| 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) | 3.33 | 7.23 | -4.28 | 0 | 2 | 0 | 26 | 243.1 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
