4-Methyl-4-pentyloxane-2,6-dione

Base Information

• Chemical Name: 4-Methyl-4-pentyloxane-2,6-dione
• CAS No.: 61871-53-2
• Molecular Formula: C11H18O3
• DSSTox Substance ID: DTXSID70491562
• Wikidata: Q82336276

Synonyms:4-METHYL-4-PENTYLOXANE-2,6-DIONE;61871-53-2;DTXSID70491562

Chemical Property of 4-Methyl-4-pentyloxane-2,6-dione

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 198.125594432
• Heavy Atom Count: 14
• Complexity: 217

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC1(CC(=O)OC(=O)C1)C

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