[1-(Pyren-1-yl)ethyl]propanedioic acid

Base Information

• Chemical Name: [1-(Pyren-1-yl)ethyl]propanedioic acid
• CAS No.: 6272-56-6
• Molecular Formula: C21H16O4
• Molecular Weight: 332.3493
• NSC Number: 30872
• DSSTox Substance ID: DTXSID00283316
• Mol file: 6272-56-6.mol

Synonyms:6272-56-6;[1-(pyren-1-yl)ethyl]propanedioic acid;NSC30872;DTXSID00283316;NSC 30872;NSC-30872

Chemical Property of [1-(Pyren-1-yl)ethyl]propanedioic acid

Chemical Property:

• Vapor Pressure: 2.9E-14mmHg at 25°C
• Boiling Point: 579.3°Cat760mmHg
• Flash Point: 318.2°C
• Density: 1.416g/cm³
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 332.10485899
• Heavy Atom Count: 25
• Complexity: 530

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1)C(C(=O)O)C(=O)O