Benz(j)aceanthrylene, 1,2-dihydro-3-(methoxymethyl)-

Base Information

• Chemical Name: Benz(j)aceanthrylene, 1,2-dihydro-3-(methoxymethyl)-
• CAS No.: 116016-22-9
• Molecular Formula: C22H18O
• Molecular Weight: 298.4
• DSSTox Substance ID: DTXSID00151268
• Wikidata: Q83017698

Synonyms:Benz(j)aceanthrylene, 1,2-dihydro-3-(methoxymethyl)-;116016-22-9;3-Methoxy-3-methylcholanthrene;DTXSID00151268

Chemical Property of Benz(j)aceanthrylene, 1,2-dihydro-3-(methoxymethyl)-

Chemical Property:

• Vapor Pressure: 4.51E-10mmHg at 25°C
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 298.135765193
• Heavy Atom Count: 23
• Complexity: 432

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MSDS Files:

Useful:

• Canonical SMILES: COCC1=C2CCC3=C2C(=CC4=C3C=CC5=CC=CC=C54)C=C1

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