| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 14 | No |
Popular Name: 6-methoxy-2H-chromene-3-carbonitrile 6-methoxy-2H-chromene-3-carbonit…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 57543-71-2 , [57543-71-2]
| 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) | 2.11 | 2.16 | -6.42 | 0 | 3 | 0 | 42 | 187.198 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 70 - 72 | KeyOrganics |
| MP | 72 - 74 | Enamine Building Blocks |
| MP | 72...74 | Enamine Building Blocks |
| MP | 75° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | WO1998052935A1 | IBM Patent Data |
