| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2004 | 10 | Yes |
Popular Name: 2-Fluoro-4-Methylbenzonitrile 2-Fluoro-4-Methylbenzonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 85070-67-3 , [85070-67-3]
2-Fluoro-4-(Trifluoromethyl)Benzonitrile [146070-34-0]; .
2-fluoro-4-methyl benzonitrile
2-FLUORO-4-METHYLBENZENECARBONITRILE
2-Fluoro-4-methylbenzonitirile
2-Fluoro-4-methylbenzonitrile 98%
2-Fluoro-4-methylbenzonitrile, 97%
3-Fluoro-4-Methylbenzonitrile [170572-49-3]
| 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) | 2.23 | 3.59 | -6.59 | 0 | 1 | 0 | 24 | 135.141 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 50-53° | Oakwood Chemical |
| MP | 51 - 53 | Enamine Building Blocks |
| MP | 51...53 | Enamine Building Blocks |
| Melting_Point | 52-53? | Alfa-Aesar |
| Melting_Point | 52-53° | Alfa-Aesar |
| 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 |
