D-Sorbopyranose

CAS	3615-56-3
Structure
Synonyms	D-xylo-2-hexulose
IUPAC Name	(3R,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-one
Molecular Weight	180.16
Molecular Formula	C6H12O6
Canonical SMILES	C([C@H]([C@@H]([C@H](C(=O)CO)O)O)O)O
InChI	InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5-9,11-12H,1-2H2/t3-,5+,6+/m1/s1
InChI Key	BJHIKXHVCXFQLS-PYWDMBMJSA-N
Boiling Point	232.96 °C
Melting Point	163-165 °C
Purity	98%
Density	1.2805 g/ml
pKa	11.86±0.20
Appearance	Solid