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Nicofuranose , CAS No.15351-13-0
Basic Description
Synonyms | NICOFURANOSE | 15351-13-0 | Bradilan | ES 304 | Vasperdil | ES-304 | D-Fructofuranose 1,3,4,6-tetranicotinate | 12041-87-1 | DTXSID6023365 | GF99P6327K | Nicofuranose (INN) | [(2R,3R,4S,5R)-5-hydroxy-3,4-bis(pyridine-3-carbonyloxy)-5-(pyridine-3-carbonyloxymethyl)oxolan-2-yl]m |
Storage Temp | Room temperature |
Shipped In | Normal |
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Product Properties
pKa | pKa: 9.53 (Predicted), pKa: 3.10 (Predicted) |
Names and Identifiers
IUPAC Name | [(2R,3R,4S,5R)-5-hydroxy-3,4-bis(pyridine-3-carbonyloxy)-5-(pyridine-3-carbonyloxymethyl)oxolan-2-yl]methyl pyridine-3-carboxylate |
INCHI | InChI=1S/C30H24N4O10/c35-26(19-5-1-9-31-13-19)40-17-23-24(42-28(37)21-7-3-11-33-15-21)25(43-29(38)22-8-4-12-34-16-22)30(39,44-23)18-41-27(36)20-6-2-10-32-14-20/h1-16,23-25,39H,17-18H2/t23-,24-,25+,30-/m1/s1 |
InChi Key | FUWFSXZKBMCSKF-ZASNTINBSA-N |
Canonical SMILES | C1=CC(=CN=C1)C(=O)OCC2C(C(C(O2)(COC(=O)C3=CN=CC=C3)O)OC(=O)C4=CN=CC=C4)OC(=O)C5=CN=CC=C5 |
Isomeric SMILES | C1=CC(=CN=C1)C(=O)OC[C@@H]2[C@H]([C@@H]([C@](O2)(COC(=O)C3=CN=CC=C3)O)OC(=O)C4=CN=CC=C4)OC(=O)C5=CN=CC=C5 |
PubChem CID | 25495 |
Molecular Weight | 600.55 |
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Chemical and Physical Properties
Refractive Index | n20D1.66 (Predicted) |
Boil Point(°C) | 756.00° C at 760 mmHg (Predicted) |
Melt Point(°C) | 133-136° C |
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