trans-9,10-Dihydro-9,10-dihydroxy-3-methylcholanthrene

Base Information

• Chemical Name: trans-9,10-Dihydro-9,10-dihydroxy-3-methylcholanthrene
• CAS No.: 67481-32-7
• Molecular Formula: C21H18O2
• Molecular Weight: 302.3664
• DSSTox Substance ID: DTXSID60986856
• Mol file: 67481-32-7.mol

Synonyms:methylcholanthrene-9,10-dihydrodiol;methylcholanthrene-9,10-dihydrodiol, (trans)-isomer;trans-9,10-dihydroxy-9,10-dihydromethylcholanthrene

Chemical Property of trans-9,10-Dihydro-9,10-dihydroxy-3-methylcholanthrene

Chemical Property:

• Boiling Point: 588.6°Cat760mmHg
• Flash Point: 282.1°C
• PSA: 40.46000
• Density: 1.378g/cm³
• LogP: 3.82110
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 302.130679813
• Heavy Atom Count: 23
• Complexity: 500

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C2CCC3=C2C(=CC4=C3C=CC5=C4C=CC(C5O)O)C=C1