2-Deoxy-2,2-difluoro-D-erythro-pentofuranose-3,5-dibenzoate-1-methanesulfonate
Bezeichnung:2-Deoxy-2,2-difluoro-D-erythro-pentofuranose-3,5-dibenzoate-1-methanesulfonate
CAS-Nr122111-11-9
Englisch Name:2-Deoxy-2,2-difluoro-D-erythro-pentofuranose-3,5-dibenzoate-1-methanesulfonate
CBNumberCB8187886
SummenformelC20H18F2O8S
Molgewicht456.41
MOL-Datei122111-11-9.mol
2-Deoxy-2,2-difluoro-D-erythro-pentofuranose-3,5-dibenzoate-1-methanesulfonate physikalisch-chemischer Eigenschaften
Schmelzpunkt | 66-74°C |
Siedepunkt | 588.4±50.0 °C(Predicted) |
Dichte | 1.46±0.1 g/cm3(Predicted) |
storage temp. | 2-8°C |
Löslichkeit | Chloroform, Methanol |
Aggregatzustand | Solid |
Farbe | Off-White to Pale Yellow |
InChI | InChI=1S/C20H18F2O8S/c1-31(25,26)30-19-20(21,22)16(29-18(24)14-10-6-3-7-11-14)15(28-19)12-27-17(23)13-8-4-2-5-9-13/h2-11,15-16,19H,12H2,1H3/t15-,16-,19?/m1/s1 |
InChIKey | LIAQHZDWFACWFK-QNRNLVPOSA-N |
SMILES | C1(OS(C)(=O)=O)O[C@H](COC(=O)C2=CC=CC=C2)[C@@H](OC(=O)C2=CC=CC=C2)C1(F)F |
CAS Datenbank | 122111-11-9(CAS DataBase Reference) |