4-Acetyl-2-(chloromethyl)phenyl 2,2-dimethylpropanoate

Base Information

• Chemical Name: 4-Acetyl-2-(chloromethyl)phenyl 2,2-dimethylpropanoate
• CAS No.: 117380-02-6
• Molecular Formula: C₁₄H₁₇ClO₃
• Molecular Weight: 268.74
• DSSTox Substance ID: DTXSID101209179

Synonyms:4-Acetyl-2-(chloromethyl)phenyl 2,2-dimethylpropanoate;DTXSID101209179;117380-02-6

Chemical Property of 4-Acetyl-2-(chloromethyl)phenyl 2,2-dimethylpropanoate

Chemical Property:

• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 268.0866221
• Heavy Atom Count: 18
• Complexity: 320

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Useful:

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

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