2-(2-Ethyl-3-oxobutyl)-1H-isoindole-1,3(2H)-dione

Base Information

• Chemical Name: 2-(2-Ethyl-3-oxobutyl)-1H-isoindole-1,3(2H)-dione
• CAS No.: 113807-41-3
• Molecular Formula: C₁₄H₁₅NO₃
• Molecular Weight: 245.278
• DSSTox Substance ID: DTXSID50551678
• Mol file: 113807-41-3.mol

Synonyms:113807-41-3;2-(2-Ethyl-3-oxobutyl)-1H-isoindole-1,3(2H)-dione;DTXSID50551678

Chemical Property of 2-(2-Ethyl-3-oxobutyl)-1H-isoindole-1,3(2H)-dione

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 245.10519334
• Heavy Atom Count: 18
• Complexity: 353

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

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