| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 12 | Yes |
Popular Name: 6-Methoxy-2(3h)-benzothiazolone 6-Methoxy-2(3h)-benzothiazolone
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CAS Numbers: 40925-65-3 , [40925-65-3]
2(3H)-Benzothiazolone, 6-methoxy- (9CI)
2-Hydroxy-6-methoxybenzothiazole
6-Methoxybenzo[d]thiazol-2(3H)-one
6-methyoxy-2(3H)-benzothiazolone
| 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) | 1.85 | 2.02 | -7.2 | 1 | 3 | 0 | 42 | 181.216 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.31 | 0.05 | -42.19 | 0 | 3 | -1 | 45 | 180.208 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
