[3-[[2-Methylpropyl(thiophene-2-carbonyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate

Base Information

• Chemical Name: [3-[[2-Methylpropyl(thiophene-2-carbonyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate
• CAS No.: 6020-67-3
• Molecular Formula: C17H21 N O4 . Br H . 3 H2 O
• Molecular Weight: 447.5428
• DSSTox Substance ID: DTXSID30412314
• Wikidata: Q82219615
• Mol file: 6020-67-3.mol

Synonyms:[3-[[2-methylpropyl(thiophene-2-carbonyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate;6020-67-3;DTXSID30412314;AKOS021603262;3-{[N-(2-METHYLPROPYL)-1-(THIOPHEN-2-YL)FORMAMIDO]METHYL}PHENYL 4-FLUOROBENZENE-1-SULFONATE

Chemical Property of [3-[[2-Methylpropyl(thiophene-2-carbonyl)amino]methyl]phenyl] 4-fluorobenzenesulfonate

Chemical Property:

• Vapor Pressure: 8.44E-15mmHg at 25°C
• Boiling Point: 609.5°C at 760 mmHg
• Flash Point: 322.4°C
• Density: 1.306g/cm³
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 447.09742869
• Heavy Atom Count: 30
• Complexity: 659

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CN(CC1=CC(=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)F)C(=O)C3=CC=CS3