1-Pyrenepropanoic acid

Base Information

• Chemical Name: 1-Pyrenepropanoic acid
• CAS No.: 61098-93-9
• Molecular Formula: C19H14O2
• Molecular Weight: 274.319
• DSSTox Substance ID: DTXSID60431255
• Nikkaji Number: J586.795I
• Wikidata: Q82245100
• Mol file: 61098-93-9.mol

Synonyms:1-Pyrenepropanoic acid;3-pyren-1-ylpropanoic Acid;61098-93-9;1-pyrenepropionic acid;SCHEMBL500317;DTXSID60431255;A901702

Chemical Property of 1-Pyrenepropanoic acid

Chemical Property:

• XLogP3: 4.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 274.099379685
• Heavy Atom Count: 21
• Complexity: 404

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CCC(=O)O