3'-Fluoro-5'-(trifluoromethyl)acetophenone

Base Information

• Chemical Name: 3'-Fluoro-5'-(trifluoromethyl)acetophenone
• CAS No.: 202664-54-8
• Molecular Formula: C9H6F4O
• Molecular Weight: 206.14
• Hs Code.: 2914700090
• European Community (EC) Number: 639-302-8
• DSSTox Substance ID: DTXSID60372119
• Wikidata: Q82159714
• Mol file: 202664-54-8.mol

Synonyms:202664-54-8;3'-Fluoro-5'-(trifluoromethyl)acetophenone;1-[3-fluoro-5-(trifluoromethyl)phenyl]ethanone;1-(3-Fluoro-5-(trifluoromethyl)phenyl)ethanone;3-fluoro-5-(trifluoromethyl)acetophenone;1-[3-fluoro-5-(trifluoromethyl)phenyl]ethan-1-one;1-(3-Fluoro-5-(trifluoromethyl)phenyl)ethan-1-one;Ethanone, 1-[3-fluoro-5-(trifluoromethyl)phenyl]-;ACETONECARBOXYMETHOXIME;Ethanone,1-[3-fluoro-5-(trifluoromethyl)phenyl]-;SCHEMBL1198922;DTXSID60372119;MFCD00061250;AKOS015853054;AB02412;CS-0102287;FT-0615699;EN300-1929907;A814367

Chemical Property of 3'-Fluoro-5'-(trifluoromethyl)acetophenone

Chemical Property:

• Vapor Pressure: 0.89mmHg at 25°C
• Refractive Index: 1.449
• Boiling Point: 180.6 °C at 760 mmHg
• Flash Point: 65.9 °C
• PSA: 17.07000
• Density: 1.299 g/cm³
• LogP: 3.04710
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 206.03547746
• Heavy Atom Count: 14
• Complexity: 223

Purity/Quality:

97% ^*data from raw suppliers

3'-Fluoro-5'-(trifluoromethyl)acetophenone 98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC(=CC(=C1)F)C(F)(F)F