Flunoprost

Base Information

• Chemical Name: Flunoprost
• CAS No.: 86348-98-3
• Molecular Formula: C22H29 F O5
• Molecular Weight: 392.46
• UNII: 8MF6L4447J
• DSSTox Substance ID: DTXSID601024697
• Nikkaji Number: J33.151A
• Wikidata: Q27270754
• NCI Thesaurus Code: C76899
• ChEMBL ID: CHEMBL3989883
• Mol file: 86348-98-3.mol

Synonyms:Flunoprost;Flunoprost [INN];86348-98-3;UNII-8MF6L4447J;8MF6L4447J;(Z)-7-[(1R,2R,3R,5R)-5-fluoro-3-hydroxy-2-[(E,3R)-3-hydroxy-4-phenoxybut-1-enyl]cyclopentyl]hept-5-enoic acid;(Z)-7-((1R,2R,3R,5R)-5-Fluoro-3-hydroxy-2-((E)-(3R)-3-hydroxy-4-phenoxy-1-butenyl)cyclopentyl)-5-heptenoic acid;ZK-95377;SCHEMBL1230709;CHEMBL3989883;DTXSID601024697;Q27270754;(Z)-7-((1R,2R,3R,5R)-5-Fluoro-3-hydroxy-2-((E)-3R)-3-hydroxy-4-phenoxy-1-butenyl)cyclopentyl)-5-heptenoic acid.

Chemical Property of Flunoprost

Chemical Property:

• Vapor Pressure: 6.55E-14mmHg at 25°C
• Boiling Point: 571.7°C at 760 mmHg
• Flash Point: 299.6°C
• PSA: 86.99000
• Density: 1.21g/cm³
• LogP: 3.51880
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 11
• Exact Mass: 392.19990218
• Heavy Atom Count: 28
• Complexity: 515

Purity/Quality:

98%,99%, ^*data from raw suppliers

FLUNOPROST 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C(C(C1F)CC=CCCCC(=O)O)C=CC(COC2=CC=CC=C2)O)O
• Isomeric SMILES: C1[C@H]([C@@H]([C@H]([C@@H]1F)C/C=C\CCCC(=O)O)/C=C/[C@H](COC2=CC=CC=C2)O)O