3-Butyl-3-ethylheptan-2-one

Base Information

• Chemical Name: 3-Butyl-3-ethylheptan-2-one
• CAS No.: 61517-91-7
• Molecular Formula: C₁₃H₂₆O
• Molecular Weight: 198.349
• DSSTox Substance ID: DTXSID40508979
• Wikidata: Q82366251

Synonyms:3-BUTYL-3-ETHYLHEPTAN-2-ONE;61517-91-7;DTXSID40508979

Chemical Property of 3-Butyl-3-ethylheptan-2-one

Chemical Property:

• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 8
• Exact Mass: 198.198365449
• Heavy Atom Count: 14
• Complexity: 153

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC)(CCCC)C(=O)C

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