Benzenesulfonic acid, 2,5-bis[(1,3-dioxobutyl)amino]-

Base Information

• Chemical Name: Benzenesulfonic acid, 2,5-bis[(1,3-dioxobutyl)amino]-
• CAS No.: 70185-87-4
• Molecular Formula: C14H16N2O7S
• Molecular Weight: 356.351
• DSSTox Substance ID: DTXSID8072037
• Nikkaji Number: J441.334B
• Wikidata: Q72445314
• Mol file: 70185-87-4.mol

Synonyms:70185-87-4;2,5-bis(3-oxobutanoylamino)benzenesulfonic acid;2,5-BIS[(1,3-DIOXOBUTYL)AMINO]BENZENESULFONIC ACID;Benzenesulfonic acid, 2,5-bis[(1,3-dioxobutyl)amino]-;2,5-Diacetoacetamidobenzenesulfonic acid;2,5-Bis(acetoacetamido)benzenesulfonic acid;2,5-Bis[(1,3-dioxobutyl)amino]benzenesulfonicAcid;Benzenesulfonic acid,2,5-bis[(1,3-dioxobutyl)amino]-;Benzenesulfonic acid, 2,5-bis((1,3-dioxobutyl)amino)-;Bis Acetoacet Paramine Acid;DTXSID8072037;SCHEMBL10704337;FT-0641272;A836796;2,5-BIS(3-OXOBUTANAMIDO)BENZENESULFONIC ACID

Chemical Property of Benzenesulfonic acid, 2,5-bis[(1,3-dioxobutyl)amino]-

Chemical Property:

• Refractive Index: 1.602
• PSA: 155.09000
• Density: 1.493 g/cm³
• LogP: 1.99530
• XLogP3: -0.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 356.06782203
• Heavy Atom Count: 24
• Complexity: 624

Purity/Quality:

99.5% ^*data from raw suppliers

2,5-Bis[(1,3-dioxobutyl)amino]benzenesulfonicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)CC(=O)NC1=CC(=C(C=C1)NC(=O)CC(=O)C)S(=O)(=O)O