2-(2,5-Dioxohexyl)-1H-isoindole-1,3(2H)-dione

Base Information

• Chemical Name: 2-(2,5-Dioxohexyl)-1H-isoindole-1,3(2H)-dione
• CAS No.: 63272-09-3
• Molecular Formula: C14H13NO4
• Molecular Weight: 259.262
• DSSTox Substance ID: DTXSID80493072
• Nikkaji Number: J2.872.050E
• Wikidata: Q82339486

Synonyms:63272-09-3;2-(2,5-Dioxohexyl)-1H-isoindole-1,3(2H)-dione;6-phthalimido-2,5-hexanedione;SCHEMBL10671092;DTXSID80493072;IWBDCYSDDXGBII-UHFFFAOYSA-N

Chemical Property of 2-(2,5-Dioxohexyl)-1H-isoindole-1,3(2H)-dione

Chemical Property:

• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 259.08445790
• Heavy Atom Count: 19
• Complexity: 405

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)CCC(=O)CN1C(=O)C2=CC=CC=C2C1=O

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