2-(2-Methyl-2-nitropropyl)-2,3-dihydro-1H-inden-1-one

Base Information

• Chemical Name: 2-(2-Methyl-2-nitropropyl)-2,3-dihydro-1H-inden-1-one
• CAS No.: 89718-60-5
• Molecular Formula: C13H15NO3
• Molecular Weight: 233.26300
• European Community (EC) Number: 618-293-4
• DSSTox Substance ID: DTXSID70508427

Synonyms:89718-60-5;2-(2-Methyl-2-nitropropyl)-2,3-dihydro-1H-inden-1-one;DTXSID70508427

Chemical Property of 2-(2-Methyl-2-nitropropyl)-2,3-dihydro-1H-inden-1-one

Chemical Property:

• PSA: 62.89000
• LogP: 3.01020
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 233.10519334
• Heavy Atom Count: 17
• Complexity: 332

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(CC1CC2=CC=CC=C2C1=O)[N+](=O)[O-]

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