6-Hydroxy-5-oxo-1,3,6-cycloheptatriene-1-carboxaldehyde

Base Information

• Chemical Name: 6-Hydroxy-5-oxo-1,3,6-cycloheptatriene-1-carboxaldehyde
• CAS No.: 17459-32-4
• Molecular Formula: C₈H₆O₃
• Molecular Weight: 150.134
• DSSTox Substance ID: DTXSID301206119

Synonyms:6-Hydroxy-5-oxo-1,3,6-cycloheptatriene-1-carboxaldehyde;DTXSID301206119;17459-32-4

Chemical Property of 6-Hydroxy-5-oxo-1,3,6-cycloheptatriene-1-carboxaldehyde

Chemical Property:

• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 150.031694049
• Heavy Atom Count: 11
• Complexity: 282

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MSDS Files:

Useful:

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

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