| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2004 | 12 | Yes |
Popular Name: 2-Chloro-3,6-difluorophenylacetonitrile 2-Chloro-3,6-difluorophenylaceto…
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CAS Numbers: 261762-54-3 , 886501-33-3 , N/A
2-(2-Chloro-3,6-difluorophenyl)acetonitrile
2-Chloro-3,6-Difluorophenylacetopnitrile
| 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) | 2.76 | 4.05 | -6.93 | 0 | 1 | 0 | 24 | 187.576 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT-HARMFUL | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.