3-(Thiophen-2-yl)-5-(trifluoromethyl)isoxazole

Base Information

• Chemical Name: 3-(Thiophen-2-yl)-5-(trifluoromethyl)isoxazole
• CAS No.: 175203-89-1
• Molecular Formula: C8H4F3NOS
• Molecular Weight: 219.18
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID40352954
• Nikkaji Number: J2.243.173K
• Wikidata: Q82130393
• Mol file: 175203-89-1.mol

Synonyms:175203-89-1;3-(Thiophen-2-yl)-5-(trifluoromethyl)isoxazole;3-[Thien-2-yl-5-(trifluoromethyl)]isoxazole;3-thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole;3-(thiophen-2-yl)-5-(trifluoromethyl)-1,2-oxazole;3-(2-thienyl)-5-(trifluoromethyl)isoxazole;Isoxazole, 3-(2-thienyl)-5-(trifluoromethyl)-;SCHEMBL2761387;DTXSID40352954;HMS1612K20;CCG-48403;MFCD00276611;STK806395;AKOS001650779;FS-1175;CS-0336816;FT-0613894;Isoxazole,3-(2-thienyl)-5-(trifluoromethyl)-;A811892;SR-01000637949-1

Chemical Property of 3-(Thiophen-2-yl)-5-(trifluoromethyl)isoxazole

Chemical Property:

• Vapor Pressure: 0.000771mmHg at 25°C
• Melting Point: 57-59°C
• Refractive Index: 1.465
• Boiling Point: 281.6 °C at 760 mmHg
• Flash Point: 124.1 °C
• PSA: 54.27000
• Density: 1.425 g/cm³
• LogP: 3.42190
• Storage Temp.: 2-8°C
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 218.99656941
• Heavy Atom Count: 14
• Complexity: 211

Purity/Quality:

98%min ^*data from raw suppliers

3-[thien-2-yl-5-(trifluoromethyl)]isoxazole ^*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=CSC(=C1)C2=NOC(=C2)C(F)(F)F