7-Oxo-cyclopentyl-prostaglandin I2

Base Information

• Chemical Name: 7-Oxo-cyclopentyl-prostaglandin I2
• CAS No.: 111319-88-1
• Molecular Formula: C21H32 O5
• Molecular Weight: 364.48
• Mol file: 111319-88-1.mol

Synonyms:7-oxo-cyclopentyl-prostaglandin I2;7-oxocyclopentyl-PGI2;CH 5084;CH-5084;Chinoin 5084

Chemical Property of 7-Oxo-cyclopentyl-prostaglandin I2

Chemical Property:

• Vapor Pressure: 9.22E-15mmHg at 25°C
• Boiling Point: 557.7°Cat760mmHg
• Flash Point: 305.1°C
• PSA: 94.83000
• Density: 1.239g/cm³
• LogP: 3.25110
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 10
• Exact Mass: 364.22497412
• Heavy Atom Count: 26
• Complexity: 551

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC(C=CC1C(CC2C1C(=O)C(=CCCCC(=O)O)C2)O)O
• Isomeric SMILES: CCCCC[C@@H](/C=C/[C@H]1[C@@H](C[C@H]2[C@@H]1C(=O)/C(=C\CCCC(=O)O)/C2)O)O