| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 10 | No |
Popular Name: Dimethyl fluoromalonate Dimethyl fluoromalonate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 344-14-9 , [344-14-9]
2-Fluoro-malonic acid dimethyl ester
Dimethyl Fluoromalonate [344-14-9]
| 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) | 0.32 | 3.5 | -9.58 | 0 | 4 | 0 | 53 | 150.105 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 111-112?/45mm | Alfa-Aesar |
| Boiling_Point | 111-112°/45mm | Alfa-Aesar |
| MP | 16 - 18 | Enamine Building Blocks |
| MP | 16...18 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Fluorochem |
| Purity | 98% | Matrix Scientific |
| Notes | Active fluoromethylene group, useful reagent for the synthesis of fluoro-heterocycles, e.g Pyrimidines | Apollo Scientific |
| Notes | also can produce fluorinated trisubstituted alkenes, ask for refs. | Apollo Scientific |
| Warnings | IRRITANT-HARMFUL, TOXIC | Matrix Scientific |
| Warnings | Toxic/Irritant-Harmful | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.