3-[(1,2,4-Thiadiazole-5-sulfonyl)methyl]-2H-1-benzopyran-2-one

Base Information

• Chemical Name: 3-[(1,2,4-Thiadiazole-5-sulfonyl)methyl]-2H-1-benzopyran-2-one
• CAS No.: 922505-38-2
• Molecular Formula: C12H8N2O4S2
• DSSTox Substance ID: DTXSID10580747
• Wikidata: Q82471678

Synonyms:922505-38-2;DTXSID10580747;3-[(1,2,4-Thiadiazole-5-sulfonyl)methyl]-2H-1-benzopyran-2-one

Chemical Property of 3-[(1,2,4-Thiadiazole-5-sulfonyl)methyl]-2H-1-benzopyran-2-one

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 307.99254909
• Heavy Atom Count: 20
• Complexity: 526

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C(C(=O)O2)CS(=O)(=O)C3=NC=NS3

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