| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2004 | 11 | Yes |
Popular Name: 3-Chloro-4-fluorophenylacetonitrile 3-Chloro-4-fluorophenylacetonitrile
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CAS Numbers: 658-98-0 , 75279-56-0 , [658-98-0]
(3-Chloro-4-fluoro-phenyl)-acetonitrile
2-(3-chloro-4-fluorophenyl)acetonitrile
3-Chloro-4-fluoro benzeneacetonitrile
3-Chloro-4-fluorobenzyl cyanide
| 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 | 3.34 | -10.37 | 0 | 1 | 0 | 24 | 169.586 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 130-134°/7 Torr | Matrix Scientific |
| Purity | 97% | Matrix Scientific |
| Warnings | TOXIC | Matrix Scientific |
