Hexylb-D-thioglucopyranoside

Catalog	BBC85618195
CAS	85618-19-5
Structure
Synonyms	Nonyl 2-acetamido-2-deoxy-β-D-glucopyranoside
IUPAC Name	(2S,3R,4S,5S,6R)-2-hexylsulfanyl-6-(hydroxymethyl)oxane-3,4,5-triol
Molecular Weight	280.38
Molecular Formula	C12H24O5S
Canonical SMILES	CCCCCCS[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
InChI	InChI=1S/C12H24O5S/c1-2-3-4-5-6-18-12-11(16)10(15)9(14)8(7-13)17-12/h8-16H,2-7H2,1H3/t8-,9-,10+,11-,12+/m1/s1
InChI Key	ATFNYTMEOCLMPS-ZIQFBCGOSA-N
Boiling Point	470.529ºC at 760 mmHg
Melting Point	56-58 °C
Flash Point	238.368ºC
Purity	98%
Density	1.266g/cm³
Appearance	White to off-white waxy
Solubility in Water	Slightly