7-(Trifluoromethyl)quinoline-4-thiol

Base Information

• Chemical Name: 7-(Trifluoromethyl)quinoline-4-thiol
• CAS No.: 64415-07-2
• Molecular Formula: C10H6 F3 N S
• Molecular Weight: 229.226
• Hs Code.: 2933499090
• European Community (EC) Number: 264-875-2
• DSSTox Substance ID: DTXSID90982987
• Nikkaji Number: J236.385B
• Mol file: 64415-07-2.mol

Synonyms:7-(Trifluoromethyl)quinoline-4-thiol;64415-07-2;7-Trifluoromethyl-4-quinolinethiol;7-(trifluoromethyl)-1H-quinoline-4-thione;4-Quinolinethiol, 7-(trifluoromethyl)-;EINECS 264-875-2;7-(trifluoromethyl)-4-quinolinethiol;SCHEMBL2201230;SCHEMBL10750364;DBWDEWRMEKXOFI-UHFFFAOYSA-;DTXSID90982987;7-Trifluoromethyl-4quinoline-thiol;C10-H6-F3-N-S;7-trifluoromethyl-quinoline-4-thiol;BCP33156;7-Trifluoromethyl-4-quinoline-thiol;MFCD00006780;AKOS002684254;AKOS005174707;AS-62010;7-(Trifluoromethyl)quinoline-4(1H)-thione;7-(Trifluoromethyl)quinoline-4-thiol, 95%;CS-0063833;FT-0640941;A12719;A904087;AI-204/31700009

Chemical Property of 7-(Trifluoromethyl)quinoline-4-thiol

Chemical Property:

• Vapor Pressure: 0.0176mmHg at 25°C
• Melting Point: 222-225 °C(lit.)
• Boiling Point: 254.1°C at 760 mmHg
• PKA: 0.39±0.30(Predicted)
• Flash Point: 107.5°C
• PSA: 51.69000
• Density: 1.44g/cm³
• LogP: 3.54230
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 229.01730486
• Heavy Atom Count: 15
• Complexity: 298

Purity/Quality:

97% ^*data from raw suppliers

7-(Trifluoromethyl)quinoline-4-thiol 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC2=C(C=C1C(F)(F)F)NC=CC2=S
• Uses: 7-(Trifluoromethyl)quinoline-4-thiol was used to investigate the mechanism of generation of lipid-poor particles from high-density lipoprotein induced by cholesteryl ester transfer protein.