| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 12 | Yes |
Popular Name: 2-methoxy-4,6-dimethylnicotinonitrile 2-methoxy-4,6-dimethylnicotinoni…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 64415-39-1 , 65515-39-1 , [65515-39-1]
| 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) | 1.62 | 2.78 | -7.88 | 0 | 3 | 0 | 46 | 162.192 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.62 | 3.48 | -36.4 | 1 | 3 | 1 | 47 | 163.2 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks |
| melting_point | 93 - 95 | KeyOrganics |
| purity | 95 | Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| MP | 96 - 98 | Enamine Building Blocks |
| MP | 96...98 | Enamine Building Blocks |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
