| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 10 | Yes |
Popular Name: 5-Chloro-2-fluorobenzonitrile 5-Chloro-2-fluorobenzonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 57381-34-7 , [57381-34-7]
| 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) | 2.46 | 3.12 | -5.42 | 0 | 1 | 0 | 24 | 155.559 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 66-68° | Oakwood Chemical |
| Melting_Point | 66-69? | Alfa-Aesar |
| Melting_Point | 66-69° | Alfa-Aesar |
| MP | 67-70° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.