| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 13 | No |
Popular Name: 4-methoxy-2-nitrobenzaldehyde 4-methoxy-2-nitrobenzaldehyde
Find On: PubMed — Wikipedia — Google
CAS Numbers: 22996-21-0 , [22996-21-0]
| 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) | 1.67 | 3.98 | -6.81 | 0 | 5 | 0 | 72 | 181.147 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks |
| MP | 91 - 93 | Enamine Building Blocks |
| MP | 91...93 | Enamine Building Blocks |
| MP | 92.1-93° | Oakwood Chemical |
| purity | 95 | Enamine Building Blocks |
| Purity | 95+% | Matrix Scientific |
| Purity | 97% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
| Warnings | Irritant/Store in Freezer | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.