3,4,6-tri-O-acetyl-2-azido-2-deoxy-alpha-D-galactopyranosyl iodide

Base Information

• Chemical Name: 3,4,6-tri-O-acetyl-2-azido-2-deoxy-alpha-D-galactopyranosyl iodide
• CAS No.: 68733-27-7
• Molecular Formula: C₁₂H₁₆IN₃O₇
• Molecular Weight: 441.179
• DSSTox Substance ID: DTXSID201174620
• Nikkaji Number: J1.216.830F
• Mol file: 68733-27-7.mol

Synonyms:JUWPYVJKIMHAEP-ZIQFBCGOSA-N;DTXSID201174620;3,4,6-tri-O-acetyl-2-azido-2-deoxy-alpha-D-galactopyranosyl iodide;2-Azido-2-deoxy-3-O,4-O,6-O-triacetyl-alpha-D-galactopyranosyl iodide;alpha-D-Galactopyranosyl iodide, 2-azido-2-deoxy-, 3,4,6-triacetate;68733-27-7

Chemical Property of 3,4,6-tri-O-acetyl-2-azido-2-deoxy-alpha-D-galactopyranosyl iodide

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 8
• Exact Mass: 441.00330
• Heavy Atom Count: 23
• Complexity: 523

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)OCC1C(C(C(C(O1)I)N=[N+]=[N-])OC(=O)C)OC(=O)C
• Isomeric SMILES: CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)I)N=[N+]=[N-])OC(=O)C)OC(=O)C