3-(3-Chlorophenyl)-1,1,1-trifluoro-2-propanone

Base Information

• Chemical Name: 3-(3-Chlorophenyl)-1,1,1-trifluoro-2-propanone
• CAS No.: 139521-25-8
• Molecular Formula: C9H6ClF3O
• Molecular Weight: 222.59200
• Hs Code.: 2914700090
• DSSTox Substance ID: DTXSID70568440
• Wikidata: Q82454691
• Mol file: 139521-25-8.mol

Synonyms:3-(3-CHLOROPHENYL)-1,1,1-TRIFLUORO-2-PROPANONE;139521-25-8;3-(3-Chlorophenyl)-1,1,1-trifluoropropan-2-one;MFCD03844188;DTXSID70568440;AKOS011795153;A885980;2-Propanone, 3-(3-chlorophenyl)-1,1,1-trifluoro-

Chemical Property of 3-(3-Chlorophenyl)-1,1,1-trifluoro-2-propanone

Chemical Property:

• Vapor Pressure: 0.117mmHg at 25°C
• Boiling Point: 219.7oC at 760 mmHg
• Flash Point: 86.7oC
• PSA: 17.07000
• Density: 1.355g/cm3
• LogP: 3.01390
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 222.0059270
• Heavy Atom Count: 14
• Complexity: 215

Purity/Quality:

96% ^*data from raw suppliers

3-(3-chlorophenyl)-1,1,1-trifluoro-2-propanone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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