| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 14 | No |
Popular Name: 4,4,4-Trifluoro-1-(2-furyl)-1,3-butanedione 4,4,4-Trifluoro-1-(2-furyl)-1,3-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1173466-55-1 , 1300732-79-9 , 326-16-9 , 326-90-9 , [326-90-9]
1-(Fur-2-yl)-4,4,4-trifluorobutane-1,3-dione
1-(Fur-2-yl)-4,4,4-trifluorobutane-1,3-dione 99%
2-(3-Oxo-4,4,4-trifluorobutanoyl)furan
4,4,4-Trifluoro-1-(2-furyl)-1,3-butanedione, 98%
4,4,4-Trifluoro-1-(furan-2-yl)butane-1,3-dione
sodium (2Z)-1,1,1-trifluoro-4-(2-furyl)-4-oxobut-2-en-2-olate
| 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) | 2.27 | 4.63 | -41.83 | 0 | 3 | -1 | 53 | 205.111 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.83 | 3.85 | -8.09 | 1 | 3 | 0 | 50 | 206.119 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 16 - 18 | Enamine Building Blocks |
| MP | 16...18 | Enamine Building Blocks |
| Melting_Point | 20-21? | Alfa-Aesar |
| Melting_Point | 20-21° | Alfa-Aesar |
| Boiling_Point | 203? | Alfa-Aesar |
| Boiling_Point | 203° | Alfa-Aesar |
| BP | 84 / 10 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 99% | Matrix Scientific |
| PUBCHEM_PATENT_ID | EP0433024B1 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
