cis-4-(3-Methoxybenzoyl)cyclohexane-1-carboxylic acid

Base Information

• Chemical Name: cis-4-(3-Methoxybenzoyl)cyclohexane-1-carboxylic acid
• CAS No.: 735269-93-9
• Molecular Formula: C15H18O4
• Molecular Weight: 262.30
• DSSTox Substance ID: DTXSID501220983,DTXSID501226236
• Mol file: 735269-93-9.mol

Synonyms:cis-4-(3-methoxybenzoyl)cyclohexane-1-carboxylic acid;735269-93-9;736136-06-4;TRANS-4-(3-METHOXYBENZOYL)CYCLOHEXANE-1-CARBOXYLIC ACID;cis-4-(3-Methoxybenzoyl)cyclohexanecarboxylic acid;trans-4-(3-Methoxybenzoyl)cyclohexanecarboxylic acid;4-(3-methoxybenzoyl)cyclohexane-1-carboxylic acid;MFCD01311340;MFCD01319771;DTXSID501220983;DTXSID501226236;AKOS016017362;AKOS016017443;cis-4-(3-Methoxybenzoyl)cyclohexanecarboxylicacid

Chemical Property of cis-4-(3-Methoxybenzoyl)cyclohexane-1-carboxylic acid

Chemical Property:

• PKA: 4.81±0.25(Predicted)
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 262.12050905
• Heavy Atom Count: 19
• Complexity: 331

Purity/Quality:

99% ^*data from raw suppliers

Cis-4-(3-methoxybenzoyl)cyclohexane-1-carboxylicacid 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=CC(=C1)C(=O)C2CCC(CC2)C(=O)O

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