| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2005 | 11 | No |
Popular Name: 4-Cyano-2-fluorobenzyl bromide 4-Cyano-2-fluorobenzyl bromide
Find On: PubMed — Wikipedia — Google
CAS Numbers: 105942-09-4 , 125568-73-2 , [105942-09-4]
"4-Cyano-2-fluorobenzyl bromide, 98%"
2-Fluoro-4-cyanobenzyl bromide
4-(Bromomethyl)-3-fluorobenzonitrile
4-Bromomethyl-3-fluorobenzonitrile
4-Bromomethyl-3-fluorobenzonitrile, 95%
| 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) | 2.49 | 2.71 | -5.99 | 0 | 1 | 0 | 24 | 214.037 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 73-75° | Oakwood Chemical |
| MP | 75 - 77 | Enamine Building Blocks |
| Melting_Point | 75-79? dec | Alfa-Aesar |
| MP | 75...77 | Enamine Building Blocks |
| MP | 77 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 98% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.