1-Oxododecyl-D-glucopyranoside

• CAS: 60415-67-0
• Catalog Number: ACM60415670
• Category: Other Products
• Molecular Weight: 362.4
• Molecular Formula: C18H34O7
• Synonyms: 1-Oxo-dodecyl-d-glucopyranoside
• IUPAC Name: [(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] dodecanoate
• InChI: InChI=1S/C18H34O7/c1-2-3-4-5-6-7-8-9-10-11-14(20)25-18-17(23)16(22)15(21)13(12-19)24-18/h13,15-19,21-23H,2-12H2,1H3/t13-,15-,16+,17-,18?/m1/s1
• InChI Key: HABWUWJGNVZVPU-SRKZOOFXSA-N
• Melting Point: 115-133 °C
• Appearance: White crystals or powder
• Complexity: 363
• Exact Mass: 362.23045342
• Formal Charge: 0
• Heavy Atom Count: 25
• Hydrogen Bond Acceptor Count: 7
• Hydrogen Bond Donor Count: 4
• Isomeric SMILES: CCCCCCCCCCCC(=O)OC1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
• MDL Number: MFCD02683040
• Monoisotopic Mass: 362.23045342
• Rotatable Bond Count: 13
• Topological Polar Surface Area: 116 Ų
• XLogP3-AA: 3.1