(Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]cyclopentyl]hept-4-enoic acid

Base Information

• Chemical Name: (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]cyclopentyl]hept-4-enoic acid
• CAS No.: 57931-23-4
• Molecular Formula: C22H38O5
• Molecular Weight: 382.5341
• Mol file: 57931-23-4.mol

Synonyms:16,16-DDPGF1alpha;16,16-dimethyl-delta(4)-cis-PGF1alpha;16,16-dimethyl-delta(4)-cis-prostaglandin F1alpha;16,16-dimethyl-delta(4)-PGF1alpha;16,16-dimethyl-delta(4)-prostaglandin F1alpha

Chemical Property of (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]cyclopentyl]hept-4-enoic acid

Chemical Property:

• Vapor Pressure: 5.95E-14mmHg at 25°C
• Boiling Point: 540.8°Cat760mmHg
• Flash Point: 294.9°C
• PSA: 97.99000
• Density: 1.123g/cm³
• LogP: 3.67900
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 12
• Exact Mass: 382.27192431
• Heavy Atom Count: 27
• Complexity: 497

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(C)(C)C(C=CC1C(CC(C1CCC=CCCC(=O)O)O)O)O
• Isomeric SMILES: CCCCC(C)(C)[C@@H](/C=C/[C@H]1[C@@H](C[C@@H]([C@@H]1CC/C=C\CCC(=O)O)O)O)O