2(3H)-Benzothiazolimine, 3-(2-(4-pyridinylsulfinyl)ethyl)-6-(trifluoromethoxy)-, ethanedioate (1:1)

Base Information

• Chemical Name: 2(3H)-Benzothiazolimine, 3-(2-(4-pyridinylsulfinyl)ethyl)-6-(trifluoromethoxy)-, ethanedioate (1:1)
• CAS No.: 130997-76-1
• Molecular Formula: C17H14F3N3O6S2
• Molecular Weight: 477.4348
• DSSTox Substance ID: DTXSID60927027
• Mol file: 130997-76-1.mol

Synonyms:2-Imino-3-(2-(4-pyridylsulphinyl)ethyl)-6-trifluoroomethoxybenzothiazoline oxalate;130997-76-1;2(3H)-Benzothiazolimine, 3-(2-(4-pyridinylsulfinyl)ethyl)-6-(trifluoromethoxy)-, ethanedioate (1:1);DTXSID60927027;C15H12F3N3O2S2.C2H2O4;LS-40871;C15-H12-F3-N3-O2-S2.C2-H2-O4;Oxalic acid--3-[2-(pyridine-4-sulfinyl)ethyl]-6-(trifluoromethoxy)-1,3-benzothiazol-2(3H)-imine (1/1)

Chemical Property of 2(3H)-Benzothiazolimine, 3-(2-(4-pyridinylsulfinyl)ethyl)-6-(trifluoromethoxy)-, ethanedioate (1:1)

Chemical Property:

• Vapor Pressure: 2.17E-11mmHg at 25°C
• Boiling Point: 531.8°Cat760mmHg
• Flash Point: 275.4°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 6
• Exact Mass: 477.02761201
• Heavy Atom Count: 31
• Complexity: 586

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1OC(F)(F)F)SC(=N)N2CCS(=O)C3=CC=NC=C3.C(=O)(C(=O)O)O