3-Methylthiophene-2-sulfonyl isocyanate

Base Information

• Chemical Name: 3-Methylthiophene-2-sulfonyl isocyanate
• CAS No.: 88100-86-1
• Molecular Formula: C6H5NO3S2
• Molecular Weight: 203.23900
• DSSTox Substance ID: DTXSID20603673

Synonyms:3-Methylthiophene-2-sulfonyl isocyanate;88100-86-1;SCHEMBL10754639;DTXSID20603673

Chemical Property of 3-Methylthiophene-2-sulfonyl isocyanate

Chemical Property:

• Boiling Point: 300.3±30.0 °C(Predicted)
• PSA: 100.19000
• Density: 1.48±0.1 g/cm3(Predicted)
• LogP: 2.16180
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 202.97108537
• Heavy Atom Count: 12
• Complexity: 299

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(SC=C1)S(=O)(=O)N=C=O

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