D-gulo-2-Octulose, 4,8-anhydro-1,3-dideoxy-

Base Information

• Chemical Name: D-gulo-2-Octulose, 4,8-anhydro-1,3-dideoxy-
• CAS No.: 439685-73-1
• Molecular Formula: C₈H₁₄O₅
• Molecular Weight: 190.196
• European Community (EC) Number: 610-159-3
• Nikkaji Number: J1.756.643A
• ChEMBL ID: CHEMBL452116

Synonyms:D-gulo-2-Octulose, 4,8-anhydro-1,3-dideoxy-;439685-73-1;1-beta-D-Xylopyranosylacetone;CHEMBL452116;SCHEMBL1900465;1-((2S,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)propan-2-one

Chemical Property of D-gulo-2-Octulose, 4,8-anhydro-1,3-dideoxy-

Chemical Property:

• Boiling Point: 371.7±42.0 °C(Predicted)
• Density: 1.361±0.06 g/cm3(Predicted)
• XLogP3: -2.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 190.08412354
• Heavy Atom Count: 13
• Complexity: 193

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)CC1C(C(C(CO1)O)O)O
• Isomeric SMILES: CC(=O)C[C@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O

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