Benzo[a]pyrenetetrol I 2

(7R,8S,9R,10R)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8,9,10-tetrol

Also Known As: Benzo[a]pyrenetetrol I 2|(+)-cis-BPT|Benzo(a)pyrenetetrol II 1|AC1L2AD0|J1.147I|7,8,9,10-Tetrahydroxy-7,8,9,10-tetrahydrobenzo(a)pyrene|(7R,8S,9R,10R)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8,9,10-tetrol|7,8,9,10-Tetrahydrobenzo[a]pyrene-7beta,8alpha,9alpha,10alpha-tetrol|(3R,4R,5S,6R)-pentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(18),2(7),8,10,12,14,16,19-octaene-3,4,5,6-tetrol|Benzo(a)pyrene-7,8,9,10-tetrol, 7,8,9,10-tetrahydro-, (7alpha,8beta,9beta,10beta)-(+-)-|Benzo[a]pyrenetetrol I 2; Benzo[a]pyrene-7,8,9,10-tetrol, 7,8,9,10-tetrahydro-, (7R,8S,9R,10R)-rel-; Benzo[a]pyrene-7,8,9,10-tetrol, 7,8,9,10-tetrahydro-, (7a,8ss,9ss,10ss)-; rel-(7R,8S,9R,10R)-7,8,9,10-Tetrahydrobenzo[a]pyrene-7,8,9,10-tetrol; (+/-)-Benzo[a]pyrene-r-7,t-8,t-9,t-10-tet

Molecular Formula	C20H16O4
Molecular Weight	320.10486 g/mol
LogP	2.39
Topological Polar Surface Area	80.92 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	4
Rotatable Bonds	0
Exact Mass	320.10486
Heavy Atoms	24
Complexity	1071.6

Chemical Identifiers

CAS Number	61490-68-4
SMILES	C1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4[C@H]([C@H]([C@H]([C@@H]5O)O)O)O)C=C2