| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2004 | 14 | Yes |
Popular Name: 1-(2-propynyl)-1H-indole-2,3-dione 1-(2-propynyl)-1H-indole-2,3-dione
Find On: PubMed — Wikipedia — Google
CAS Numbers: 4290-87-3 , [4290-87-3]
1-(prop-2-yn-1-yl)-2,3-dihydro-1H-indole-2,3-dione
| 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) | 1.06 | 5.45 | -11.33 | 0 | 3 | 0 | 39 | 185.182 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 153 - 155 | Enamine Building Blocks |
| MP | 153...155 | Enamine Building Blocks |
| melting_point | 158 - 161 | KeyOrganics |
| MP | 158-161° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
