Goniopypyrone

Base Information

• Chemical Name: Goniopypyrone
• CAS No.: 129578-07-0
• Molecular Formula: C13H14 O5
• Molecular Weight: 250.25
• DSSTox Substance ID: DTXSID901317665
• Wikidata: Q105328473
• Mol file: 129578-07-0.mol

Synonyms:goniopypyrone

Chemical Property of Goniopypyrone

Chemical Property:

• Vapor Pressure: 8.15E-13mmHg at 25°C
• Melting Point: 179-182 °C
• Boiling Point: 547.4°Cat760mmHg
• PKA: 12.71±0.60(Predicted)
• Flash Point: 216.8°C
• PSA: 75.99000
• Density: 1.41g/cm³
• LogP: 0.16380
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 250.08412354
• Heavy Atom Count: 18
• Complexity: 325

Purity/Quality:

HPLC≥98% ^*data from raw suppliers

Goniopypyrone ≥98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2C(C(C(C(O2)C3=CC=CC=C3)O)OC1=O)O
• Isomeric SMILES: C1[C@H]2C([C@H]([C@@H]([C@@H](O2)C3=CC=CC=C3)O)OC1=O)O
• Uses: (+)-Goniopypyrone shows significant cytotoxicity against 3PS murine lymphocytic leukemia cells.