2-Fluoro-1-methyl-3-(trifluoromethyl)benzene

Base Information

• Chemical Name: 2-Fluoro-1-methyl-3-(trifluoromethyl)benzene
• CAS No.: 1214331-63-1
• Molecular Formula: C8H6F4
• Molecular Weight: 178.1268528
• Hs Code.: 2903999090
• DSSTox Substance ID: DTXSID30591512
• Wikidata: Q82485293
• Mol file: 1214331-63-1.mol

Synonyms:1214331-63-1;2-Fluoro-1-methyl-3-(trifluoromethyl)benzene;2-Fluoro-3-trifluoromethyltoluene;2-Fluoro-3-(Trifluoromethyl)Toluene;2-Fluoro-3-methylbenzotrifluoride;Benzene, 2-fluoro-1-methyl-3-(trifluoromethyl)-;SCHEMBL476650;DTXSID30591512;DFIWLUFOIKBHKO-UHFFFAOYSA-N;JQJROTAJVIREBJ-UHFFFAOYSA-N;CL8820;MFCD13185663;AKOS015890544;AS-46113;DB-011017;2-Fluoro-1-methyl-3-trifluoromethyl-benzene;CS-0442441

Chemical Property of 2-Fluoro-1-methyl-3-(trifluoromethyl)benzene

Chemical Property:

• Boiling Point: 138.9±35.0 °C(Predicted)
• PSA: 0.00000
• Density: 1.241±0.06 g/cm3(Predicted)
• LogP: 3.15290
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 178.04056284
• Heavy Atom Count: 12
• Complexity: 152

Purity/Quality:

98.5% ^*data from raw suppliers

2-Fluoro-3-trifluoromethyltoluene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=CC=C1)C(F)(F)F)F