| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 11 | Yes |
Popular Name: 2-Chloro-4-fluorophenylacetonitrile 2-Chloro-4-fluorophenylacetonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 75279-56-0 , [75279-56-0]
2-(2-chloro-4-fluorophenyl)acetonitrile
2-Chloro-4-fluorobenzyl cyanide
2-Chloro-4-fluorobenzylcyanide
2-Chloro-4-fluorophenylacetonitrile 97%
2-Chloro-4-fluorophenylacetonitrile, 97%
| 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) | 2.67 | 3.33 | -8.41 | 0 | 1 | 0 | 24 | 169.586 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 67 - 69 | Enamine Building Blocks |
| Melting_Point | 67-69? | Alfa-Aesar |
| Melting_Point | 67-69° | Alfa-Aesar |
| MP | 67...69 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| 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.