O-Allyl-alpha-D-glucose

Base Information

• Chemical Name: O-Allyl-alpha-D-glucose
• CAS No.: 94031-20-6
• Molecular Formula: C9H16O6
• Molecular Weight: 220.21974
• European Community (EC) Number: 301-725-8,616-122-8
• DSSTox Substance ID: DTXSID60240344
• Nikkaji Number: J36.668D
• Wikidata: Q83123158
• Mol file: 94031-20-6.mol

Synonyms:7464-56-4;Allyl a-D-Glucopyranoside;Allyl alpha-D-Glucopyranoside;O-Allyl-alpha-D-glucose;Allyl-alpha-D-glucopyranoside;EINECS 301-725-8;94031-20-6;(2S,3R,4S,5S,6R)-2-(allyloxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol;(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-prop-2-enoxyoxane-3,4,5-triol;Allyl ?-D-Glucopyranoside;SCHEMBL251764;Allyl alpha -D-Glucopyranoside;DTXSID60240344;XJNKZTHFPGIJNS-ZEBDFXRSSA-N;BCP18064;1-O-(2-propenyl)-alpha-D-glucose;MFCD04973540;AKOS015919323;AS-58631;F72435;W-203706;(2R,3S,4S,5R,6S)-2-(HYDROXYMETHYL)-6-(PROP-2-EN-1-YLOXY)OXANE-3,4,5-TRIOL

Chemical Property of O-Allyl-alpha-D-glucose

Chemical Property:

• PSA: 99.38000
• LogP: -2.01110
• XLogP3: -1.6
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 220.09468823
• Heavy Atom Count: 15
• Complexity: 209

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C=CCOC1C(C(C(C(O1)CO)O)O)O
• Isomeric SMILES: C=CCO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O