| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 11 | Yes |
Popular Name: 4-Bromo-2,6-difluorobenzonitrile 4-Bromo-2,6-difluorobenzonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 123843-67-4 , [123843-67-4]
2,6-Difluoro-4-bromobenzonitrile
4-Bromo-2,6-difluoro-benzonitrile
| 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) | 2.69 | 3.2 | -4.66 | 0 | 1 | 0 | 24 | 218 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 78-80° | Fluorochem |
| Melting_Point | 79-82? | Alfa-Aesar |
| MP | 79-82° | Matrix Scientific |
| Purity | 95+% | Matrix Scientific |
| Purity | 97% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
| Warnings | Toxic | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
