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Technology Process of 6-O-Galloylglucose

6-O-Galloylglucose

Base Information
  • Chemical Name:6-O-Galloylglucose
  • CAS No.:13186-19-1
  • Molecular Formula:C13H16 O10
  • Molecular Weight:332.26
  • Hs Code.:
  • DSSTox Substance ID:DTXSID30927372
  • Wikidata:Q82901996
  • ChEMBL ID:CHEMBL1221848
  • Mol file:13186-19-1.mol
6-O-Galloylglucose

Synonyms:6-O-galloyl-D-glucose;6-O-galloylglucose;6-O-galloylglucose, (beta-D-pyranose)-isomer;6-O-galloylglucose, (D-pyranose)-isomer

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Chemical Property of 6-O-Galloylglucose
Chemical Property:
  • Vapor Pressure:1.37E-24mmHg at 25°C 
  • Boiling Point:764.7°Cat760mmHg 
  • PKA:7.82±0.25(Predicted) 
  • Flash Point:287.5°C 
  • PSA：184.98000 
  • Density:1.712g/cm3 
  • LogP:-2.39730 
  • XLogP3:-2.3
  • Hydrogen Bond Donor Count:7
  • Hydrogen Bond Acceptor Count:10
  • Rotatable Bond Count:8
  • Exact Mass:332.07434670
  • Heavy Atom Count:23
  • Complexity:390
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:C1=C(C=C(C(=C1O)O)O)C(=O)OCC(C(C(C(C=O)O)O)O)O
  • Isomeric SMILES:C1=C(C=C(C(=C1O)O)O)C(=O)OC[C@H]([C@H]([C@@H]([C@H](C=O)O)O)O)O
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