Products 61490-68-4

CAS 61490-68-4 is the registry number for Benzo(a)pyrenetetrol I 2. Offered by: TRC. Available pack sizes: 25mg.

Structural formula: {0} (CAS {1})

(7S,8R,9S,10S)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8,9,10-tetrol (CAS 61490-68-4) is a chemical compound with the molecular formula C20H16O4 and a molecular weight of 320.3 g/mol. IUPAC name: (7S,8R,9S,10S)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8,9,10-tetrol. InChIKey: KWFVZAJQUSRMCC-HAGHYFMRSA-N.

Identity
Molecular formulaC20H16O4
Molecular weight320.3 g/mol
IUPAC name(7S,8R,9S,10S)-7,8,9,10-tetrahydrobenzo[a]pyrene-7,8,9,10-tetrol
InChIKeyKWFVZAJQUSRMCC-HAGHYFMRSA-N
SMILESC1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4[C@@H]([C@@H]([C@@H]([C@H]5O)O)O)O)C=C2

Computed by PubChem (NCBI)