3-Acetyl-2-methoxycyclohepta-2,4,6-trien-1-one

Base Information

• Chemical Name: 3-Acetyl-2-methoxycyclohepta-2,4,6-trien-1-one
• CAS No.: 72023-83-7
• Molecular Formula: C10H10O3
• Molecular Weight: 178.188
• DSSTox Substance ID: DTXSID90501475

Synonyms:3-Acetyl-2-methoxycyclohepta-2,4,6-trien-1-one;72023-83-7;DTXSID90501475

Chemical Property of 3-Acetyl-2-methoxycyclohepta-2,4,6-trien-1-one

Chemical Property:

• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 178.062994177
• Heavy Atom Count: 13
• Complexity: 332

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

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

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