2-Chloro-3-(trifluoromethyl)phenylacetic acid

Base Information

• Chemical Name: 2-Chloro-3-(trifluoromethyl)phenylacetic acid
• CAS No.: 22902-84-7
• Molecular Formula: C9H6ClF3O2
• Molecular Weight: 238.594
• Hs Code.: 2916399090
• DSSTox Substance ID: DTXSID30396963
• Wikidata: Q82197946
• Mol file: 22902-84-7.mol

Synonyms:22902-84-7;2-Chloro-3-(trifluoromethyl)phenylacetic acid;2-[2-chloro-3-(trifluoromethyl)phenyl]acetic Acid;2-(2-Chloro-3-(trifluoromethyl)phenyl)acetic acid;Benzeneacetic acid, 2-chloro-3-(trifluoromethyl)-;SCHEMBL6605072;DTXSID30396963;MFCD04115992;AKOS015956729;JS-4328;EN300-9453285

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

Chemical Property:

• Melting Point: 131-133℃
• Boiling Point: 291.9±35.0 °C(Predicted)
• PKA: 3.90±0.10(Predicted)
• PSA: 37.30000
• Density: 1.469±0.06 g/cm3(Predicted)
• LogP: 2.98590
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 238.0008416
• Heavy Atom Count: 15
• Complexity: 242

Purity/Quality:

97% ^*data from raw suppliers

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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