4-Nitrophenyl 6-O-alpha-D-Galactopyranosyl-beta-D-Glucopyranoside
[CAS# 104872-92-6]

Identification

• Name: 4-Nitrophenyl 6-O-alpha-D-Galactopyranosyl-beta-D-Glucopyranoside
• Synonyms: 4-NITROPHENYL-β-D-MELIBIOSIDE
• Molecular Formula: C₁₈H₂₅NO₁₃
• Molecular Weight: 463.39
• CAS Registry Number: 104872-92-6
• SMILES: C1=CC(=CC=C1[N+](=O)[O-])O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O)O)O)O)O
• InChI: 1S/C18H25NO13/c20-5-9-11(21)13(23)15(25)17(31-9)29-6-10-12(22)14(24)16(26)18(32-10)30-8-3-1-7(2-4-8)19(27)28/h1-4,9-18,20-26H,5-6H2/t9-,10-,11+,12-,13+,14+,15-,16-,17+,18-/m1/s1
• InChIKey: ISCYUJSLZREARS-VHQOPQIKSA-N

Properties

• Density: 1.7±0.1g/cm³ (Cal.)
• Boiling point: 791.3±60.0°C at 760 mmHg (Cal.)
• Flash point: 432.4±32.9°C (Cal.)
• Refractive index: 1.671 (Cal.)