(4R,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol
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![(4R,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d12c8129cbbc4d8bab62ed9ab8ea6df8.png "(4R,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol")
(4R,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol
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CAS No:
83516-23-8
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Formula:
C21H16O2
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Chemical Name:
(4R,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol
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Synonyms:
94850-10-9;Benzo(a)pyrene-4,5-diol, 4,5-dihydro-7-methyl-, cis-;DTXSID20915248;83516-23-8;7-Methyl-4,5-dihydrobenzo[pqr]tetraphene-4,5-diol
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CAS No:
(4R,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol Basic Attributes
300.3 g/mol
300.115029749 g/mol
Computed Properties
Molecular Weight:300.3
XLogP3:4.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:300.115029749
Monoisotopic Mass:300.115029749
Topological Polar Surface Area:40.5
Heavy Atom Count:23
Complexity:463
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of (4R,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol
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