2-[(3,4-Dimethoxyphenyl)(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione

Base Information

• Chemical Name: 2-[(3,4-Dimethoxyphenyl)(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione
• CAS No.: 5105-26-0
• Molecular Formula: C25H32O6
• Molecular Weight: 428.518
• DSSTox Substance ID: DTXSID20385144

Synonyms:2-[(3,4-dimethoxyphenyl)(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione;5105-26-0;CBMicro_004929;ChemDiv1_027380;Oprea1_610226;HMS664M12;DTXSID20385144;SMSF0003255;STK041486;AKOS000486458;AKOS022078700;CB06920;BIM-0004812.P001;SR-01000509931;SR-01000509931-1

Chemical Property of 2-[(3,4-Dimethoxyphenyl)(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-5,5-dimethylcyclohexane-1,3-dione

Chemical Property:

• Vapor Pressure: 1.43E-14mmHg at 25°C
• Boiling Point: 585.9°Cat760mmHg
• Flash Point: 194.5°C
• Density: 1.173g/cm³
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 428.21988874
• Heavy Atom Count: 31
• Complexity: 757

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CC(=O)C(C(=O)C1)C(C2=CC(=C(C=C2)OC)OC)C3=C(CC(CC3=O)(C)C)O)C

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