CAS | 618-65-5 |
Structure | |
Synonyms | Salycylaldehyde β-D-glucopyranoside |
IUPAC Name | 2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzaldehyde |
Molecular Weight | 284.26 |
Molecular Formula | C13H16O7 |
Canonical SMILES | C1=CC=C(C(=C1)C=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O |
InChI | InChI=1S/C13H16O7/c14-5-7-3-1-2-4-8(7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-5,9-13,15-18H,6H2/t9-,10-,11+,12-,13-/m1/s1 |
InChI Key | BGOFCVIGEYGEOF-UJPOAAIJSA-N |
Boiling Point | 386.76 °C |
Melting Point | 178 °C (lit.) |
Purity | 98% |
Density | 1.35 g/ml |
Refractive Index | -62 ° (C=0.8, H₂O) |
pKa | 12.77±0.70 |
Solubility in Water | 16.39 g/L |
Appearance | White to yellow powder |
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