Pentosan Polysulfate

Base Information

• Chemical Name: Pentosan Polysulfate
• CAS No.: 37300-21-3
• Deprecated CAS: 11096-31-4,39432-58-1,42613-02-5
• Molecular Weight: 0
• Wikipedia: Pentosan_polysulfate
• Wikidata: Q7165276
• NCI Thesaurus Code: C1755
• RXCUI: 155046
• Metabolomics Workbench ID: 43000
• ChEMBL ID: CHEMBL4073796
• Mol file: 37300-21-3.mol

Synonyms:BAY 946;BAY-946;Elmiron;Fibrocid;Hemoclar;HOE 946;HOE BAY 946;HOE-946;HOE-BAY 946;HOE-BAY-946;Pentosan Polysulfate;Pentosan Polysulfate Sodium;Pentosan Polysulphate Sodium;Pentosan Sulfuric Polyester;Pentosane Sulfuric Polyester;Polyester, Pentosan Sulfuric;Polyester, Pentosane Sulfuric;Polypentose Sulfate;Polysulfate Sodium, Pentosan;Polysulfate, Pentosan;Polysulfated Xylan;Polysulphate Sodium, Pentosan;PZ 68;PZ-68;PZ68;Sodium, Pentosan Polysulfate;Sodium, Pentosan Polysulphate;SP 54;SP 54, Tavan;SP-54;SP54;SP54, Xylan;Sulfate, Polypentose;Sulfate, Xylan;Sulfuric Polyester, Pentosan;Sulfuric Polyester, Pentosane;Tavan SP 54;Xylan SP54;Xylan Sulfate;Xylan, Polysulfated

Chemical Property of Pentosan Polysulfate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 356.07000
• Density: 2.26g/cm³
• LogP: -0.48740
• XLogP3: -5.6
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 21
• Rotatable Bond Count: 10
• Exact Mass: 601.92234227
• Heavy Atom Count: 35
• Complexity: 1140

Purity/Quality:

99% ^*data from raw suppliers

PentosanPolysulfate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C(C(C(O1)OC2COC(C(C2OS(=O)(=O)O)OS(=O)(=O)O)O)OS(=O)(=O)O)OS(=O)(=O)O)O
• Isomeric SMILES: C1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2CO[C@H]([C@@H]([C@H]2OS(=O)(=O)O)OS(=O)(=O)O)O)OS(=O)(=O)O)OS(=O)(=O)O)O