4-oxahexacyclo[11.6.2.02,8.03,5.010,20.017,21]henicosa-1(20),2(8),3(5),9,11,13(21),14,16,18-nonaene-6,7-diol
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4-oxahexacyclo[11.6.2.02,8.03,5.010,20.017,21]henicosa-1(20),2(8),3(5),9,11,13(21),14,16,18-nonaene-6,7-diol
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CAS No:
72485-26-8
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Formula:
C20H12O3
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Chemical Name:
4-oxahexacyclo[11.6.2.02,8.03,5.010,20.017,21]henicosa-1(20),2(8),3(5),9,11,13(21),14,16,18-nonaene-6,7-diol
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Synonyms:
72485-26-8;Q42412393;7,8-Dihydrobenzo[1,12]tetrapheno[10,11-b]oxirene-7,8-diol;Benzo(a)pyrene 7,8-dihydrodiol-9,10-epoxide;7,8-Dihydroxy-9,10-epoxy-7,8-dihydrobenzo(a)pyrene;BENZO(a)PYRENE, 7,8-DIHYDRO-7,8-DIHYDROXY-9,10-EPOXY-;DTXSID50993312;9,10-Epoxy-7,8-dihydrobenzo[a]pyrene-7,8-diol;7,8-dihydroxy-7,8-dihydro-9,10 epoxy-benzo[a]pyrene
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CAS No:
4-oxahexacyclo[11.6.2.02,8.03,5.010,20.017,21]henicosa-1(20),2(8),3(5),9,11,13(21),14,16,18-nonaene-6,7-diol Basic Attributes
300.3 g/mol
300.078644241 g/mol
Computed Properties
Molecular Weight:300.3
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:300.078644241
Monoisotopic Mass:300.078644241
Topological Polar Surface Area:53
Heavy Atom Count:23
Complexity:569
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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