5-Bromo-4-chloro-3-indolyl-beta-D-glucoside

• CAS: 15548-60-4
• Catalog Number: ACM15548604
• Category: Other Products
• Molecular Weight: 408.63
• Molecular Formula: C14H15BrClNO6
• Synonyms: 4-Chloro-5-bromo-1H-indole-3-yl β-D-glucopyranoside
• IUPAC Name: (2S,3R,4S,5S,6R)-2-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
• Canonical SMILES: C1=CC(=C(C2=C1NC=C2O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)Cl)Br
• InChI: InChI=1S/C14H15BrClNO6/c15-5-1-2-6-9(10(5)16)7(3-17-6)22-14-13(21)12(20)11(19)8(4-18)23-14/h1-3,8,11-14,17-21H,4H2/t8-,11-,12+,13-,14-/m1/s1
• InChI Key: OPIFSICVWOWJMJ-LNNRFACYSA-N
• Boiling Point: 673.9±55.0 °C
• Melting Point: 249-251 °C
• Density: 1.882±0.06 g/ml
• Appearance: Solid
• pKa: 12.74±0.70

Synthetic Use

Upstream Synthesis Route 1

• 1607828-53-4

• 15548-60-4

Reference: [1]Boettcher, Stephan; Thiem, Joachim
[European Journal of Organic Chemistry, 2014, vol. 2014, # 3, p. 564 - 574]