3-Deoxy-3-fluoro-d-gluconic acid

Base Information

• Chemical Name: 3-Deoxy-3-fluoro-d-gluconic acid
• CAS No.: 29724-55-8
• Molecular Formula: C6H11 F O6
• Molecular Weight: 198.15
• UNII: E5890EO417
• DSSTox Substance ID: DTXSID50183877
• Nikkaji Number: J527.827I
• Wikidata: Q27894390
• Mol file: 29724-55-8.mol

Synonyms:3-deoxy-3-fluorogluconic acid;3DFGA

Chemical Property of 3-Deoxy-3-fluoro-d-gluconic acid

Chemical Property:

• Vapor Pressure: 2.85E-17mmHg at 25°C
• Boiling Point: 607.1°C at 760 mmHg
• Flash Point: 320.9°C
• PSA: 118.22000
• Density: 1.662g/cm³
• LogP: -2.51590
• XLogP3: -2.3
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 198.05396623
• Heavy Atom Count: 13
• Complexity: 175

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(C(C(C(C(=O)O)O)F)O)O)O
• Isomeric SMILES: C([C@H]([C@H]([C@@H]([C@H](C(=O)O)O)F)O)O)O

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