3-Chloro-2-fluoro-6-(trifluoromethyl)benzoic acid

Base Information

• Chemical Name: 3-Chloro-2-fluoro-6-(trifluoromethyl)benzoic acid
• CAS No.: 186517-41-9
• Molecular Formula: C₈H₃ClF₄O₂
• Molecular Weight: 242.557
• Hs Code.: 2916399090
• European Community (EC) Number: 630-278-4
• DSSTox Substance ID: DTXSID70378687
• Wikidata: Q82168207
• Mol file: 186517-41-9.mol

Synonyms:3-Chloro-2-fluoro-6-(trifluoromethyl)benzoic acid;186517-41-9;MFCD01631342;Benzoic acid,3-chloro-2-fluoro-6-(trifluoromethyl)-;SCHEMBL7927678;DTXSID70378687;AKOS005258504;JS-4168;CS-0038448;FT-0615333;3-chloro-2-fluoro-6-trifluoromethylbenzoic acid;3-Chloro-2-fluoro-6-(trifluoromethyl)benzoicacid;A813050;3-Chloro-2-fluoro-6-(trifluoromethyl)benzoic acid, AldrichCPR

Chemical Property of 3-Chloro-2-fluoro-6-(trifluoromethyl)benzoic acid

Chemical Property:

• Vapor Pressure: 0.00526mmHg at 25°C
• Melting Point: 96-98 °C
• Refractive Index: 1.479
• Boiling Point: 263.2 °C at 760 mmHg
• Flash Point: 113 °C
• PSA: 37.30000
• Density: 1.599 g/cm³
• LogP: 3.19610
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 241.9757697
• Heavy Atom Count: 15
• Complexity: 256

Purity/Quality:

98%min ^*data from raw suppliers

3-Chloro-2-fluoro-6-(trifluoromethyl)benzoicAcid ^*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: C1=CC(=C(C(=C1C(F)(F)F)C(=O)O)F)Cl