2-[Dimethyliminio(trifluoromethyl)-$l^{4}-sulfanyl]phenolate tetrafluoroborate

Base Information

• Chemical Name: 2-[Dimethyliminio(trifluoromethyl)-$l^{4}-sulfanyl]phenolate tetrafluoroborate
• CAS No.: 1046786-08-6
• Molecular Formula: C9H11F3NOS^.BF4
• Molecular Weight: 325.05
• Hs Code.: 29309090
• DSSTox Substance ID: DTXSID90703038
• Mol file: 1046786-08-6.mol

Synonyms:2-[dimethyliminio(trifluoromethyl)-$l^{4}-sulfanyl]phenolate tetrafluoroborate;DTXSID90703038;WCYIGBJHCKFTFE-UHFFFAOYSA-N;MFCD12545962;FT-0652595;A801035;[(Oxido)phenyl(trifluoromethyl)-sulfanylidene]dimethylammonium tetrafluoroborate;2-[dimethylazaniumylidene(trifluoromethyl)-$l^{4}-sulfanyl]phenolate tetrafluoroborate;2-[dimethylazaniumylidene(trifluoromethyl)-lambda4-sulfanyl]phenolate;tetrafluoroborate

Chemical Property of 2-[Dimethyliminio(trifluoromethyl)-$l^{4}-sulfanyl]phenolate tetrafluoroborate

Chemical Property:

• Melting Point: 85-90℃
• PSA: 28.46000
• LogP: 4.47110
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 1
• Exact Mass: 324.0464374
• Heavy Atom Count: 20
• Complexity: 280

Purity/Quality:

98%,99%, ^*data from raw suppliers

[(Oxido)phenyl(trifluoromethyl)-lambda4-sulfanylidene]dimethylammoniumTetrafluoroborate ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [B-](F)(F)(F)F.C[N+](=S(C1=CC=CC=C1[O-])C(F)(F)F)C
• Uses: Reagent for the preparation of monofluoromethyl esters and ethers