di-Calciphor

Base Information

• Chemical Name: di-Calciphor
• CAS No.: 135608-06-9
• Molecular Formula: C44H68 O8
• Molecular Weight: 725.01
• Nikkaji Number: J671.244D
• Mol file: 135608-06-9.mol

Synonyms:16,16'-dimethyl prostaglandin B1 dimer;di-Calciphor

Chemical Property of di-Calciphor

Chemical Property:

• Vapor Pressure: 3.33E-32mmHg at 25°C
• Boiling Point: 853.1°Cat760mmHg
• PKA: 4.77±0.10(Predicted)
• Flash Point: 483.6°C
• PSA: 142.88000
• Density: 1.085g/cm³
• LogP: 10.51540
• XLogP3: 9.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 28
• Exact Mass: 724.49141912
• Heavy Atom Count: 52
• Complexity: 1360

Purity/Quality:

99% ^*data from raw suppliers

DI-CALCIPHOR 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(C)(C)C(=O)C=CC1=C(C(=O)C(C1)C(CC2=C(C(=O)CC2)CCCCCCC(=O)O)C(=O)C(C)(C)CCCC)CCCCCCC(=O)O
• Isomeric SMILES: CCCCC(C)(C)C(=O)/C=C/C1=C(C(=O)C(C1)C(CC2=C(C(=O)CC2)CCCCCCC(=O)O)C(=O)C(C)(C)CCCC)CCCCCCC(=O)O