3,4,5-Trifluoroanisole

Base Information

• Chemical Name: 3,4,5-Trifluoroanisole
• CAS No.: 203245-17-4
• Molecular Formula: C7H5F3O
• Molecular Weight: 162.111
• Hs Code.: 2909309090
• European Community (EC) Number: 670-637-2
• DSSTox Substance ID: DTXSID50380304
• Wikidata: Q82170489
• Mol file: 203245-17-4.mol

Synonyms:3,4,5-Trifluoroanisole;203245-17-4;1,2,3-trifluoro-5-methoxybenzene;Benzene, 1,2,3-trifluoro-5-methoxy-;SCHEMBL1998090;SCHEMBL12015242;DTXSID50380304;WVGMXLCSROHOIY-UHFFFAOYSA-N;AMY10171;1,2,3-trifluoro-5-methoxy-benzene;CL9417;MFCD00042397;AKOS006228777;JS-4194;SB73975;CS-0195145;FT-0676266;A814441

Chemical Property of 3,4,5-Trifluoroanisole

Chemical Property:

• Vapor Pressure: 9.55mmHg at 25°C
• Melting Point: 20oC
• Refractive Index: 1.449
• Boiling Point: 39oC/1mm
• Flash Point: 39°C/1mm
• PSA: 9.23000
• Density: 1.285g/cm3
• LogP: 2.11250
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 162.02924926
• Heavy Atom Count: 11
• Complexity: 119

Purity/Quality:

99% ^*data from raw suppliers

3,4,5-Trifluoroanisole ^*data from reagent suppliers

Safty Information:

• Hazard Codes: F

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C(C(=C1)F)F)F
• Uses: 3,4,5-Trifluoroanisole is used as a pharmaceutical intermediate.