| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 14 | Yes |
Popular Name: Methyl 3-methylthianaphthene-2-carboxylate Methyl 3-methylthianaphthene-2-c…
Find On: PubMed — Wikipedia — Google
CAS Number: 3133-81-1
3-Methylbenzo[b]thiophene-2-carboxylic acid methyl ester
Methyl 3-methylbenzo[b]thiophene-2-carboxylate
Methyl 3-methylbenzo[b]thiophene-2-carboxylate, 97%
| 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) | 3.35 | 1.54 | -6.94 | 0 | 2 | 0 | 26 | 206.266 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 102-105? | Alfa-Aesar |
| Melting_Point | 102-105° | Alfa-Aesar |
| Purity | 95% | Fluorochem |
