2-(4-Nitrophenyl)-1,3-dioxane-4,6-dione

Base Information

• Chemical Name: 2-(4-Nitrophenyl)-1,3-dioxane-4,6-dione
• CAS No.: 58413-48-2
• Molecular Formula: C10H7NO6
• Molecular Weight: 237.1657
• NSC Number: 128177
• DSSTox Substance ID: DTXSID60299094
• Wikidata: Q82041289
• ChEMBL ID: CHEMBL1904947

Synonyms:58413-48-2;MLS002919981;2-(4-nitrophenyl)-1,3-dioxane-4,6-dione;NSC128177;SCHEMBL6175110;CHEMBL1904947;DTXSID60299094;NSC-128177;SMR001797580

Chemical Property of 2-(4-Nitrophenyl)-1,3-dioxane-4,6-dione

Chemical Property:

• Vapor Pressure: 1.98E-13mmHg at 25°C
• Boiling Point: 579.6°Cat760mmHg
• Flash Point: 304.5°C
• Density: 1.505g/cm³
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 237.02733694
• Heavy Atom Count: 17
• Complexity: 325

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(=O)OC(OC1=O)C2=CC=C(C=C2)[N+](=O)[O-]

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