| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 5th, 2005 | 15 | Yes |
Popular Name: 3,6,7-Trimethyl-benzofuran-2-carboxylic acid 3,6,7-Trimethyl-benzofuran-2-car…
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CAS Numbers: 878417-05-1 , [878417-05-1]
3,6,7-Trimethyl-1-benzofuran-2-carboxylic 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) | 3.25 | 1.85 | -54.89 | 0 | 3 | -1 | 53 | 203.217 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
