2-Heptanone, 3-(acetyloxy)-

Base Information

• Chemical Name: 2-Heptanone, 3-(acetyloxy)-
• CAS No.: 3100-08-1
• Molecular Formula: C₉H₁₆O₃
• Molecular Weight: 172.224
• DSSTox Substance ID: DTXSID80457538
• Nikkaji Number: J2.114.233F
• Mol file: 3100-08-1.mol

Synonyms:2-Heptanone, 3-(acetyloxy)-;3-Acetoxy-2-heptanone;3100-08-1;SCHEMBL5745716;DTXSID80457538

Chemical Property of 2-Heptanone, 3-(acetyloxy)-

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 172.109944368
• Heavy Atom Count: 12
• Complexity: 163

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(C(=O)C)OC(=O)C