Methyl β-D-glucopyranoside

CAS	709-50-2
Structure
Synonyms	Methyl--D-glucoside hemihydrate
IUPAC Name	(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol
Molecular Weight	194.18
Molecular Formula	C7H14O6
Canonical SMILES	CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
InChI	InChI=1S/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3/t3-,4-,5+,6-,7-/m1/s1
InChI Key	HOVAGTYPODGVJG-XUUWZHRGSA-N
Melting Point	107-111 °C
Purity	98%
Density	1.48 g/ml
pKa	12.92±0.70
Solubility in Water	367.4 g/L (17 ºC)
Appearance	White powder