1,3,6-Pyrenetrisulfonic acid

Base Information

• Chemical Name: 1,3,6-Pyrenetrisulfonic acid
• CAS No.: 92681-38-4
• Molecular Formula: C16H10O9S3
• Molecular Weight: 442.44000
• DSSTox Substance ID: DTXSID00474944
• Wikidata: Q82305128

Synonyms:1,3,6-Pyrenetrisulfonic acid;92681-38-4;SCHEMBL3822788;DTXSID00474944

Chemical Property of 1,3,6-Pyrenetrisulfonic acid

Chemical Property:

• PSA: 188.25000
• Density: 1.921±0.06 g/cm3(Predicted)
• LogP: 5.56650
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 3
• Exact Mass: 441.94869541
• Heavy Atom Count: 28
• Complexity: 939

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C3C(=C(C=C2S(=O)(=O)O)S(=O)(=O)O)C=CC4=C(C=CC1=C43)S(=O)(=O)O

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