Benzothiazolium, 3-ethyl-2-(2-(2-furanyl)-2-oxoethylidene)-2,3-dihydro-3,5-dimethyl-, methyl sulfate

Base Information

• Chemical Name: Benzothiazolium, 3-ethyl-2-(2-(2-furanyl)-2-oxoethylidene)-2,3-dihydro-3,5-dimethyl-, methyl sulfate
• CAS No.: 68298-84-0
• Molecular Formula: C18H21NO6S2
• Molecular Weight: 411.4924

Synonyms:2-(2-Furoylmethylene)-3-ethyl-3,5-dimethylbenzothiazolinium, methyl sulfate;C17H18NO2S.CH3O4S;2-(2-Furoylmethylene)-3-ethyl-3,5-dimethylbenzothiazolinium, methylsulfate;Benzothiazolium, 3-ethyl-2-(2-(2-furanyl)-2-oxoethylidene)-2,3-dihydro-3,5-dimethyl-, methyl sulfate;Benzothiazolium, 3-ethyl-2-(2-(2-furanyl)-2-oxoethylidene)-2,3-dihydro-3,5-dimethyl-, methyl sulfate (1:1);C17-H18-N-O2-S.C-H3-O4-S;Benzothiazolium, 3-ethyl-2-[2-(2-furanyl)-2-oxoethylidene]-2,3-dihydro-3,5-dimethyl-, methyl sulfate

Chemical Property of Benzothiazolium, 3-ethyl-2-(2-(2-furanyl)-2-oxoethylidene)-2,3-dihydro-3,5-dimethyl-, methyl sulfate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 411.08102974
• Heavy Atom Count: 27
• Complexity: 541

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC[N+]1(C2=C(C=CC(=C2)C)SC1=CC(=O)C3=CC=CO3)C.COS(=O)(=O)[O-]
• Isomeric SMILES: CC[N+]\1(C2=C(C=CC(=C2)C)S/C1=C\C(=O)C3=CC=CO3)C.COS(=O)(=O)[O-]

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