(4E)-5-methyl-4-(thiophen-2-ylmethylidene)-2-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-pyrazol-3-one

Base Information

• Chemical Name: (4E)-5-methyl-4-(thiophen-2-ylmethylidene)-2-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-pyrazol-3-one
• CAS No.: 6052-52-4
• Molecular Formula: C16H11F3N2OS
• Molecular Weight: 336.3315
• DSSTox Substance ID: DTXSID50417402

Synonyms:STK375874;6052-52-4;DTXSID50417402;AKOS005447683;BIM-0043111.P001;SR-01000226290;SR-01000226290-1;(4E)-5-methyl-4-(thiophen-2-ylmethylidene)-2-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-pyrazol-3-one

Chemical Property of (4E)-5-methyl-4-(thiophen-2-ylmethylidene)-2-[3-(trifluoromethyl)phenyl]-2,4-dihydro-3H-pyrazol-3-one

Chemical Property:

• Vapor Pressure: 1.85E-07mmHg at 25°C
• Boiling Point: 425.9°Cat760mmHg
• Flash Point: 211.3°C
• Density: 1.37g/cm³
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 336.05441864
• Heavy Atom Count: 23
• Complexity: 544

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NN(C(=O)C1=CC2=CC=CS2)C3=CC=CC(=C3)C(F)(F)F
• Isomeric SMILES: CC\1=NN(C(=O)/C1=C/C2=CC=CS2)C3=CC=CC(=C3)C(F)(F)F

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