(4S,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol
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![(4S,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/427b47829683452c8a092cd61831627a.png "(4S,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol")
(4S,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol
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CAS No:
79427-43-3
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Formula:
C21H16O2
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Chemical Name:
(4S,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol
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Synonyms:
Benzo(a)pyrene-4,5-diol, 4,5-dihydro-7-methyl-, trans-;Benzo(a)pyrene-4,5-diol, 4,5-dihydro-7-methyl-, trans-(-)-;79427-43-3;86555-42-2;(4S,5S)-7-Methyl-4,5-dihydrobenzo(a)pyrene-4,5-diol
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CAS No:
(4S,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 (4S,5S)-7-methyl-4,5-dihydrobenzo[a]pyrene-4,5-diol
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