4,7-Benzothiazoledione, 2-methyl-

Base Information

• Chemical Name: 4,7-Benzothiazoledione, 2-methyl-
• CAS No.: 839675-46-6
• Molecular Formula: C₈H₅NO₂S
• Molecular Weight: 179.199
• DSSTox Substance ID: DTXSID10461188
• Wikidata: Q82285455

Synonyms:4,7-Benzothiazoledione, 2-methyl-;839675-46-6;2-METHYL-1,3-BENZOTHIAZOLE-4,7-DIONE;2-methyl-4,7-dioxobenzothiazole;DTXSID10461188

Chemical Property of 4,7-Benzothiazoledione, 2-methyl-

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 179.00409958
• Heavy Atom Count: 12
• Complexity: 274

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC2=C(S1)C(=O)C=CC2=O

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