2,6-Diamino-N,N-dibutyltoluene-4-sulphonamide

Base Information

• Chemical Name: 2,6-Diamino-N,N-dibutyltoluene-4-sulphonamide
• CAS No.: 80198-26-1
• Molecular Formula: C15H27N3O2S
• Molecular Weight: 313.45878
• European Community (EC) Number: 279-419-8
• DSSTox Substance ID: DTXSID501001098
• Nikkaji Number: J320.241K
• Wikidata: Q82994913
• Mol file: 80198-26-1.mol

Synonyms:80198-26-1;EINECS 279-419-8;2,6-Diamino-N,N-dibutyltoluene-4-sulphonamide;3,5-diamino-N,N-dibutyl-4-methylbenzenesulfonamide;SCHEMBL10859351;C15H27N3O2S;DTXSID501001098;C15-H27-N3-O2-S;3,5-Diamino-N,N-dibutyl-4-methylbenzene-1-sulfonamide

Chemical Property of 2,6-Diamino-N,N-dibutyltoluene-4-sulphonamide

Chemical Property:

• Vapor Pressure: 3.93E-10mmHg at 25°C
• Boiling Point: 500°C at 760 mmHg
• PKA: 3.33±0.10(Predicted)
• Flash Point: 256.2°C
• PSA: 97.80000
• Density: 1.14g/cm³
• LogP: 4.99350
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 313.18239829
• Heavy Atom Count: 21
• Complexity: 374

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCN(CCCC)S(=O)(=O)C1=CC(=C(C(=C1)N)C)N