2-((2E)-3,7-Dimethyl-2,6-octadienyl)-5,6-dimethoxy-3-methyl-1,4-benzenediol

Base Information

• Chemical Name: 2-((2E)-3,7-Dimethyl-2,6-octadienyl)-5,6-dimethoxy-3-methyl-1,4-benzenediol
• CAS No.: 56275-39-9
• Molecular Formula: C19H28O4
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID701317902
• Nikkaji Number: J604.254F,J961.012J
• Metabolomics Workbench ID: 71786
• ChEMBL ID: CHEMBL2272030
• Mol file: 56275-39-9.mol

Synonyms:coenzyme Q10, reduced;ubiquinol-10

Chemical Property of 2-((2E)-3,7-Dimethyl-2,6-octadienyl)-5,6-dimethoxy-3-methyl-1,4-benzenediol

Chemical Property:

• Vapor Pressure: 3.17E-10mmHg at 25°C
• Boiling Point: 490°Cat760mmHg
• Flash Point: 250.1°C
• PSA: 58.92000
• Density: 1.06g/cm³
• LogP: 2.93210
• Storage Temp.: Amber Vial, -86°C Freezer, Under inert atmosphere
• Solubility.: Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Very Slightly)
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 320.19875937
• Heavy Atom Count: 23
• Complexity: 412

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=C(C(=C1O)OC)OC)O)CC=C(C)CCC=C(C)C
• Isomeric SMILES: CC1=C(C(=C(C(=C1O)OC)OC)O)C/C=C(\C)/CCC=C(C)C
• Uses: Reduced coenzyme Q for improving nervous system cell functions.