Benzamide, 3-amino-N-[2-[[2-(sulfooxy)ethyl]sulfonyl]ethyl]-

Base Information

• Chemical Name: Benzamide, 3-amino-N-[2-[[2-(sulfooxy)ethyl]sulfonyl]ethyl]-
• CAS No.: 121315-20-6
• Molecular Formula: C11H16N2O7S2
• Molecular Weight: 352.3839
• European Community (EC) Number: 601-770-6
• DSSTox Substance ID: DTXSID5073088
• Nikkaji Number: J1.596.625D
• Mol file: 121315-20-6.mol

Synonyms:121315-20-6;2-[2-[(3-aminobenzoyl)amino]ethylsulfonyl]ethyl hydrogen sulfate;Benzamide, 3-amino-N-[2-[[2-(sulfooxy)ethyl]sulfonyl]ethyl]-;Benzamide,3-amino-N-[2-[[2-(sulfooxy)ethyl]sulfonyl]ethyl]-;Benzamide, 3-amino-N-(2-((2-(sulfooxy)ethyl)sulfonyl)ethyl)-;EC 601-770-6;2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate;2-({2-[(3-aminobenzoyl)amino]ethyl}sulfonyl)ethyl hydrogen sulfate;DTXSID5073088;C11H16N2O7S2;C11-H16-N2-O7-S2;3-Amino-N-[2-[[2-(sulfooxy)ethyl]sulfonyl]ethyl]benzamide

Chemical Property of Benzamide, 3-amino-N-[2-[[2-(sulfooxy)ethyl]sulfonyl]ethyl]-

Chemical Property:

• Appearance/Colour: white
• Refractive Index: 1.603
• PKA: -3.85±0.18(Predicted)
• PSA: 172.45000
• Density: 1.548 g/cm³
• LogP: 2.02390
• XLogP3: -1.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 8
• Exact Mass: 352.03989320
• Heavy Atom Count: 22
• Complexity: 562

Purity/Quality:

99.9% ^*data from raw suppliers

2-[2-[(3-Aminobenzoyl)amino]ethylsulfonyl]ethyl hydrogensulfate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)N)C(=O)NCCS(=O)(=O)CCOS(=O)(=O)O