| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 19 | No |
Popular Name: 4-(3-chlorophenoxy)-3-nitrobenzenecarbaldehyde 4-(3-chlorophenoxy)-3-nitrobenze…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 320416-88-4 , 320417-03-6
| 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) | 4.02 | 2.93 | -17.07 | 0 | 5 | 0 | 72 | 277.663 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 80 - 82 | KeyOrganics |
| MP | 80-82° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.