| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 12 | Yes |
Popular Name: 5-Methoxy-2-methylbenzoic acid 5-Methoxy-2-methylbenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 3168-59-0 , [3168-59-0]
5-Methoxy-2-(2,2,2-Trifluoroethoxy)Benzoic Acid [175205-34-2]
5-Methoxy-2-methyl benzoic acid
5-Methoxy-2-methyl-benzoic acid
| 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) | 1.94 | 3.94 | -52.98 | 0 | 3 | -1 | 49 | 165.168 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 146 - 147 | MolMall (formerly Molecular Diversity Preservation International) |
| MP | 146-148° | Oakwood Chemical |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Purity | 98% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.