Helicid

CAS	80154-34-3
Structure
Synonyms	4-(beta-D-Allopyranosyloxy)benzaldehyde Helicide
IUPAC Name	4-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzaldehyde
Molecular Weight	284.26
Molecular Formula	C13H16O7
Canonical SMILES	C1=CC(=CC=C1C=O)O[C@H]2[C@@H]([C@@H]([C@@H]([C@H](O2)CO)O)O)O
InChI	InChI=1S/C13H16O7/c14-5-7-1-3-8(4-2-7)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	OLZAGZCCJJBKNZ-SYLRKERUSA-N
Boiling Point	559.9±50.0 °C
Melting Point	199-200 °C
Purity	98%
Density	1.510±0.06 g/ml
pKa	12.72±0.70
Appearance	White powder