In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 14 | Yes |
Popular Name: Methyl 6-methyl-1-benzothiophene-3-carboxylate Methyl 6-methyl-1-benzothiophene…
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CAS Numbers: , 82787-85-7
benzo[b]thiophene-3-carboxylic acid, 6-methyl-, methyl 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) | 3.09 | 7.04 | -8.02 | 0 | 2 | 0 | 26 | 206.266 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |