6-[Methyl(3-nitrophenyl)sulfamoyl]hexanoic acid

Base Information

• Chemical Name: 6-[Methyl(3-nitrophenyl)sulfamoyl]hexanoic acid
• CAS No.: 33317-49-6
• Molecular Formula: C13H18 N2 O6 S
• Molecular Weight: 330.35682
• DSSTox Substance ID: DTXSID90954947
• Wikidata: Q82934388
• Mol file: 33317-49-6.mol

Synonyms:DTXSID90954947;6-[methyl(3-nitrophenyl)sulfamoyl]hexanoic acid

Chemical Property of 6-[Methyl(3-nitrophenyl)sulfamoyl]hexanoic acid

Chemical Property:

• Vapor Pressure: 3.14E-12mmHg at 25°C
• Boiling Point: 533.9°Cat760mmHg
• Flash Point: 276.7°C
• PSA: 0.00000
• Density: 1.391g/cm³
• LogP: 0.00000
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 8
• Exact Mass: 330.08855747
• Heavy Atom Count: 22
• Complexity: 482

Purity/Quality:

99% ^*data from raw suppliers

6-[METHYL[(3-NITROPHENYL)SULPHONYL]AMINO]HEXANOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CN(C1=CC(=CC=C1)[N+](=O)[O-])S(=O)(=O)CCCCCC(=O)O

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