| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 13 | Yes |
Popular Name: 3-Cyanocoumarin 3-Cyanocoumarin
Find On: PubMed — Wikipedia — Google
CAS Numbers: 15119-34-3 , [15119-34-3]
| 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) | 1.70 | 6.35 | -14.45 | 0 | 3 | 0 | 54 | 171.155 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| M.P | 183-187 C | Indofine |
| MP | 183-187o C | Indofine |
| Melting_Point | 184-188? | Alfa-Aesar |
| Melting_Point | 184-188° | Alfa-Aesar |
| MP | 186 - 188 | Enamine Building Blocks |
| MP | 186...188 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| SOLUBILITY | Soluble in Chloroform | Indofine |
| SOLUBILITY | Soluble in Chloroform, Ethyl acetate | Indofine |
| APPEARANCE | Yellow solid | Indofine |
