3-(2-(2-Pyrimidinylsulfinyl)ethyl)-6-(trifluoromethoxy)-2(3H)-benzothiazolimine

Base Information

• Chemical Name: 3-(2-(2-Pyrimidinylsulfinyl)ethyl)-6-(trifluoromethoxy)-2(3H)-benzothiazolimine
• CAS No.: 130997-74-9
• Molecular Formula: C14H11 F3 N4 O2 S2
• Molecular Weight: 388.3879
• DSSTox Substance ID: DTXSID00927026
• Mol file: 130997-74-9.mol

Synonyms:130997-74-9;3-(2-(2-Pyrimidinylsulfinyl)ethyl)-6-(trifluoromethoxy)-2(3H)-benzothiazolimine;2-Imino-3-(2-(2-pyrimidinylsulphinyl)ethyl)-6-trifluoromethoxybenzothiazoline;2(3H)-Benzothiazolimine, 3-(2-(2-pyrimidinylsulfinyl)ethyl)-6-(trifluoromethoxy)-;2-Imino-3-[2-(2-pyrimidinylsulphinyl)ethyl]-6-trifluoromethoxybenzothiazoline;SCHEMBL9780275;C14H11F3N4O2S2;DTXSID00927026;C14-H11-F3-N4-O2-S2;LS-40874;3-[2-(Pyrimidine-2-sulfinyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2(3H)-imine

Chemical Property of 3-(2-(2-Pyrimidinylsulfinyl)ethyl)-6-(trifluoromethoxy)-2(3H)-benzothiazolimine

Chemical Property:

• Vapor Pressure: 4.92E-12mmHg at 25°C
• Boiling Point: 547.4°Cat760mmHg
• Flash Point: 284.8°C
• Density: 1.66g/cm³
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 5
• Exact Mass: 388.02755244
• Heavy Atom Count: 25
• Complexity: 517

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN=C(N=C1)S(=O)CCN2C3=C(C=C(C=C3)OC(F)(F)F)SC2=N