1,3-Dioxane-4,6-dione, 5-[(5-nitro-2-thienyl)methylene]-2-phenyl-

Base Information

• Chemical Name: 1,3-Dioxane-4,6-dione, 5-[(5-nitro-2-thienyl)methylene]-2-phenyl-
• CAS No.: 62391-00-8
• Molecular Formula: C15H9NO6S
• DSSTox Substance ID: DTXSID80486984

Synonyms:62391-00-8;1,3-Dioxane-4,6-dione, 5-[(5-nitro-2-thienyl)methylene]-2-phenyl-;DTXSID80486984

Chemical Property of 1,3-Dioxane-4,6-dione, 5-[(5-nitro-2-thienyl)methylene]-2-phenyl-

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 331.01505818
• Heavy Atom Count: 23
• Complexity: 517

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2OC(=O)C(=CC3=CC=C(S3)[N+](=O)[O-])C(=O)O2

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