4-((1-Oxo-3-phenylallyl)amino)benzenesulphonic acid

Base Information

• Chemical Name: 4-((1-Oxo-3-phenylallyl)amino)benzenesulphonic acid
• CAS No.: 89217-68-5
• Molecular Formula: C15H13 N O4 S
• Molecular Weight: 303.33302
• European Community (EC) Number: 289-480-2
• Nikkaji Number: J348.576E
• Mol file: 89217-68-5.mol

Synonyms:EINECS 289-480-2;4-((1-Oxo-3-phenylallyl)amino)benzenesulphonic acid;89217-68-5;4-[(1-oxo-3-phenylallyl)amino]benzenesulphonic acid;C15H13NO4S;C15-H13-N-O4-S;SCHEMBL11025996;4-[(1-Oxo-3-phenyl-2-propenyl)amino]benzenesulfonic acid;4-[(1-OXO-3-PHENYLALLYL)AMINO]BENZENESULFONIC ACID

Chemical Property of 4-((1-Oxo-3-phenylallyl)amino)benzenesulphonic acid

Chemical Property:

• PSA: 91.85000
• Density: 1.416g/cm³
• LogP: 3.73900
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 303.05652907
• Heavy Atom Count: 21
• Complexity: 466

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C=CC(=O)NC2=CC=C(C=C2)S(=O)(=O)O
• Isomeric SMILES: C1=CC=C(C=C1)/C=C/C(=O)NC2=CC=C(C=C2)S(=O)(=O)O