1-Trifluoroacetyl-5-fluorobenzimidazolin-2-thione

Base Information

• Chemical Name: 1-Trifluoroacetyl-5-fluorobenzimidazolin-2-thione
• CAS No.: 128691-98-5
• Molecular Formula: C9H4 F4 N2 O S
• Molecular Weight: 264.1994728
• DSSTox Substance ID: DTXSID70559838
• Wikidata: Q82442697
• Mol file: 128691-98-5.mol

Synonyms:128691-98-5;1-Trifluoroacetyl-5-fluorobenzimidazolin-2-thione;2,2,2-trifluoro-1-(5-fluoro-2-sulfanylidene-3H-benzimidazol-1-yl)ethanone;2,2,2-Trifluoro-1-(5-fluoro-2-thioxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)ethanone;DTXSID70559838;AKOS015965129;2,2,2-Trifluoro-1-(5-fluoro-2-sulfanylidene-2,3-dihydro-1H-benzimidazol-1-yl)ethan-1-one;2,2,2-trifluoro-1-(5-fluoro-2-thioxo-1,3-dihydro-benzoimidazol-1-yl)-ethanone

Chemical Property of 1-Trifluoroacetyl-5-fluorobenzimidazolin-2-thione

Chemical Property:

• PSA: 69.88000
• LogP: 3.04050
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 263.99804658
• Heavy Atom Count: 17
• Complexity: 359

Purity/Quality:

98% ^*data from raw suppliers

1-TRIFLUOROACETYL-5-FLUOROBENZIMIDAZOLIN-2-THIONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1F)NC(=S)N2C(=O)C(F)(F)F