m-((((3-Heptadecyl-1,5-dihydro-5-thioxo-4H-1,2,4-triazol-4-yl)amino)carbonyl)amino)benzenesulphonyl fluoride

Base Information

• Chemical Name: m-((((3-Heptadecyl-1,5-dihydro-5-thioxo-4H-1,2,4-triazol-4-yl)amino)carbonyl)amino)benzenesulphonyl fluoride
• CAS No.: 23455-88-1
• Molecular Formula: C26H42 F N5 O3 S2
• Molecular Weight: 555.7717832
• DSSTox Substance ID: DTXSID80946114
• Mol file: 23455-88-1.mol

Synonyms:4-[(3-heptadecyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)carbamoylamino]benzenesulfonyl fluoride;m-((((3-Heptadecyl-1,5-dihydro-5-thioxo-4H-1,2,4-triazol-4-yl)amino)carbonyl)amino)benzenesulphonyl fluoride;DTXSID80946114;N-[4-(Fluorosulfonyl)phenyl]-N'-(3-heptadecyl-5-sulfanyl-4H-1,2,4-triazol-4-yl)carbamimidic acid

Chemical Property of m-((((3-Heptadecyl-1,5-dihydro-5-thioxo-4H-1,2,4-triazol-4-yl)amino)carbonyl)amino)benzenesulphonyl fluoride

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 149.35000
• Density: 1.23g/cm³
• LogP: 9.01520
• XLogP3: 9.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 18
• Exact Mass: 555.27131073
• Heavy Atom Count: 37
• Complexity: 812

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCC1=NNC(=S)N1NC(=O)NC2=CC=C(C=C2)S(=O)(=O)F