2-Fluoro-3-(trifluoromethyl)phenylacetic acid

Base Information

• Chemical Name: 2-Fluoro-3-(trifluoromethyl)phenylacetic acid
• CAS No.: 194943-83-4
• Molecular Formula: C9H6F4O2
• Molecular Weight: 222.14
• Hs Code.: 29163990
• European Community (EC) Number: 621-116-3
• DSSTox Substance ID: DTXSID10939115
• Wikidata: Q72477326
• Mol file: 194943-83-4.mol

Synonyms:2-Fluoro-3-(trifluoromethyl)phenylacetic acid;194943-83-4;2-[2-fluoro-3-(trifluoromethyl)phenyl]acetic Acid;2-fluoro-3-trifluoromethylphenylacetic acid;2-(2-fluoro-3-(trifluoromethyl)phenyl)acetic acid;2-Fluoro-3-(trifluoromethyl)phenylaceticacid;[2-fluoro-3-(trifluoromethyl)phenyl]acetic acid;SCHEMBL305056;AMY2976;DTXSID10939115;CK1032;MFCD00061185;AKOS005258523;CS-W013119;PS-7834;BP-12806;FT-0676182;FT-0734146;EN300-76247;A813769;2-Fluoro-3-(trifluoromethyl)phenylacetic acid, 98%;J-012628

Chemical Property of 2-Fluoro-3-(trifluoromethyl)phenylacetic acid

Chemical Property:

• Vapor Pressure: 0.007mmHg at 25°C
• Melting Point: 113-116 °C(lit.)
• Refractive Index: 1.46
• Boiling Point: 258.333 °C at 760 mmHg
• PKA: 3.86±0.10(Predicted)
• Flash Point: 110.036 °C
• PSA: 37.30000
• Density: 1.437 g/cm³
• LogP: 2.47160
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 222.03039208
• Heavy Atom Count: 15
• Complexity: 239

Purity/Quality:

97% ^*data from raw suppliers

2-Fluoro-3-(trifluoromethyl)phenylacetic acid ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

Useful:

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