| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 26th, 2009 | 13 | Yes |
Popular Name: Methyl 3-methoxy-2-methylbenzoate Methyl 3-methoxy-2-methylbenzoate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 42981-93-1 , [42981-93-1]
| 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) | 2.18 | 5.06 | -6.9 | 0 | 3 | 0 | 36 | 180.203 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| melting_point | oil | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.