Methyl 2,3,6-tri-O-benzoyl-4-O-(trifluoromethanesulfonyl)-alpha-D-galactopyranoside
methyl 2,3,6-tri-O-benzoyl-4-O-trifluoromethansulfonyl-α-D-galactopyranoside · Methyl2,3,6-tri-O-benzoyl-4-O-trifluoromethanesulfonyl-a-D-galactopyranoside · METHYL 2,3,6-TRI-O-BENZOYL-4-O-TRIFLUOROMETHANESULFONONYL-A-D-GALACTOPYRANOSIDE · Methyl 2,3,6-Tri-O-benzoyl-4-O-trifluoromethanesulfononyl -α-D-galactopyranoside · METHYL-2,3,6-TRI-O-BENZOYL-4-O-TRIFLUOROMETHANSULFONYL-ALPHA-D-GALACTOPYRANOSIDE · Methyl 2,3,6-tri-O-benzoyl-4-O-trifluoromethanesulfonyl-alpha-D-galactopyranoside · METHYL 2,3,6-TRI-O-BENZOYL-4-O-TRIFLUOROMETHANESULFONONYL-ALPHA-D-GALACTOPYRANOSIDE · α-D-Galactopyranoside, methyl, 2,3,6-tribenzoate 4-(1,1,1-trifluoromethanesulfonate)
Identifikatoren & physikalische Daten
| CAS No. | 79580-70-4 |
|---|---|
| Summenformel | C29H25F3O11S |
| Durchschnittliche Molmasse | 638,6 g/mol |
| Monoisotopische Masse | 638,10696727 g/mol |
| SMILES | CO[C@H]1O[C@H](COC(=O)c2ccccc2)[C@H](OS(=O)(=O)C(F)(F)F)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |
| InChIKey | WEFZNIIQVROKGK-SUWSLWCISA-N |
| PubChem CID | 11181237 |
| DTXSID | DTXSID80457831 |
Chemische & physikalische Eigenschaften
| XLogP | 5,4 |
|---|---|
| Polarare Oberfläche (TPSA) | 149 |
| H-Brücken-Donoren | 0 |
| H-Brücken-Akzeptoren | 14 |
| Frei drehbare Bindungen | 13 |
| Schwere Atome | 44 |
| Formalladung | 0 |
| Komplexität | 1.080 |
| Schmelzpunkt | 137-139°C |
| Siedepunkt | 671.8±55.0 °C(Predicted) |
| Dichte | 1.47±0.1 g/cm3(Predicted) |
| Löslichkeit | soluble in Chloroform, Dichloromethane, Ethyl Acetate, Methanol, |
| Aggregatzustand | Solid |
| Farbe | White Crystalline |
| CAS Datenbank | 79580-70-4 |
Anwendungen & Verwendung
Verwenden
Methyl 2,3,6-Tri-O-benzoyl-4-O-trifluoromethanesulfononyl -α-D-galactopyranoside can be used as inhibitors of cellulases.