Hexylb-D-thioglucopyranoside

• Catalog Number: ACM85618195
• Product Name: Hexylb-D-thioglucopyranoside
• CAS: 85618-19-5
• Category: Heterocyclic Organic Compound
• 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
• Density: 1.266g/cm³
• Appearance: White to off-white waxy
• Exact Mass: 280.13400
• H-Bond Acceptor: 6
• H-Bond Donor: 4