3-methyl-1,2,9,10-tetrahydrobenzo[j]aceanthrylene-1,9,10-triol
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3-methyl-1,2,9,10-tetrahydrobenzo[j]aceanthrylene-1,9,10-triol
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CAS No:
68780-95-0
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Formula:
C21H18O3
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Chemical Name:
3-methyl-1,2,9,10-tetrahydrobenzo[j]aceanthrylene-1,9,10-triol
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Synonyms:
1,9,10-Trihydroxy-9,10-dihydro-3-methylcholanthrene;Cholanthrene-1,9,10-triol, 9,10-dihydro-3-methyl-;Benz(j)aceanthrylene-1,9,10-triol, 1,2,9,10-tetrahydro-3-methyl-;68780-95-0;1,2,9,10-Tetrahydro-3-methylbenz[j]aceanthrylene-1,9,10-triol
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CAS No:
3-methyl-1,2,9,10-tetrahydrobenzo[j]aceanthrylene-1,9,10-triol Basic Attributes
318.4 g/mol
318.125594432 g/mol
Computed Properties
Molecular Weight:318.4
XLogP3:2.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Exact Mass:318.125594432
Monoisotopic Mass:318.125594432
Topological Polar Surface Area:60.7
Heavy Atom Count:24
Complexity:531
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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