| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2007 | 12 | No |
Popular Name: 2-(4-Fluorophenyl)malondialdehyde 2-(4-Fluorophenyl)malondialdehyde
Find On: PubMed — Wikipedia — Google
CAS Numbers: 493036-47-8 , [493036-47-8]
| 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) | 1.18 | 4.63 | -31.63 | 0 | 2 | -1 | 40 | 165.143 | 2 | ↓ |
| Ref Reference (pH 7) | 1.18 | 4.6 | -32.23 | 0 | 2 | -1 | 40 | 165.143 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 3.69 | -17.77 | 0 | 2 | 0 | 34 | 166.151 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 165-167° | Matrix Scientific |
| MP | 167-169° | Oakwood Chemical |
| Purity | 97% | Fluorochem |
| Purity | 98% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.