| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 14 | No |
Popular Name: 1-(3,4-dihydroxyphenyl)-2-(dimethylamino)ethan-1-one hydrochloride 1-(3,4-dihydroxyphenyl)-2-(dimet…
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CAS Number: 16899-83-5
1-(3,4-Dihydroxyphenyl)-2-(dimethylamino)ethanone hydrochloride
Alpha-dimethylamino-3',4'-dihydroxyacetophenone hydrochloride
| 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) | 0.52 | -0.83 | -11.16 | 2 | 4 | 0 | 61 | 195.218 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.52 | 0.11 | -44.12 | 1 | 4 | -1 | 64 | 194.21 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 205 - 207 | Enamine Building Blocks |
| MP | 205...207 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
