1-Hydroxy-5-methylhexan-2-one

Base Information

• Chemical Name: 1-Hydroxy-5-methylhexan-2-one
• CAS No.: 68113-56-4
• Molecular Formula: C₇H₁₄O₂
• Molecular Weight: 130.187
• DSSTox Substance ID: DTXSID101303349
• Nikkaji Number: J3.503.542G

Synonyms:1-HYDROXY-5-METHYLHEXAN-2-ONE;68113-56-4;SCHEMBL2527424;DTXSID101303349;2-Hexanone, 1-hydroxy-5-methyl-;EN300-376260

Chemical Property of 1-Hydroxy-5-methylhexan-2-one

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 130.099379685
• Heavy Atom Count: 9
• Complexity: 86.9

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)CCC(=O)CO

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