Piflutixol

Base Information

• Chemical Name: Piflutixol
• CAS No.: 60756-96-9
• Molecular Formula: C24H25F4NOS
• Molecular Weight: 451.52
• DSSTox Substance ID: DTXSID201031397
• Nikkaji Number: J362.751I
• NCI Thesaurus Code: C170318
• ChEMBL ID: CHEMBL2107162

Synonyms:6-fluoro-9-(3-(4-(2-hydroxyethyl)piperidino) propylidene)-2-trifluoromethyl-thioxanthene;piflutixol;piflutixol monohydrochloride;piflutixol, (Z)-isomer

Chemical Property of Piflutixol

Chemical Property:

• Vapor Pressure: 4.76E-12mmHg at 25°C
• Boiling Point: 529.7°Cat760mmHg
• Flash Point: 274.1°C
• Density: 1.306g/cm³
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 451.15929824
• Heavy Atom Count: 31
• Complexity: 619

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCC1CCO)CCC=C2C3=C(C=C(C=C3)F)SC4=C2C=C(C=C4)C(F)(F)F
• Isomeric SMILES: C1CN(CCC1CCO)CC/C=C\2/C3=C(C=C(C=C3)F)SC4=C2C=C(C=C4)C(F)(F)F

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