Syn-Benzo(a)Chrysene-11,12-Diol-13,14-Epoxide
[CAS# 132832-27-0]

Identification

• Name: Syn-Benzo(a)Chrysene-11,12-Diol-13,14-Epoxide
• Synonyms: Syn-R-11,T-12-Dihydroxy-C-13,14-Oxy-11,12,13,14-Tetrahydrobenzo(G)Chrysene; (-)-Syn-Benzo(G)Chrysene-11,12-Dihydrodiol-13,14-Epoxide; Benzo(5,6)Chryseno(3,4-B)Oxirene-7,8-Diol, 7,8,8A,9A-Tetrahydro-, (7R,8S,8Ar,9As)-Rel-
• Molecular Formula: C₂₂H₁₆O₃
• Molecular Weight: 328.37
• CAS Registry Number: 132832-27-0
• SMILES: [C@@H]12O[C@@H]1[C@@H](O)[C@H](O)C3=CC=C5C(=C23)C4=CC=CC=C4C6=CC=CC=C56
• InChI: 1S/C22H16O3/c23-19-16-10-9-15-13-7-2-1-5-11(13)12-6-3-4-8-14(12)17(15)18(16)21-22(25-21)20(19)24/h1-10,19-24H/t19-,20+,21+,22-/m1/s1
• InChIKey: GZHHSQMUVHHNOY-CLAROIROSA-N

Properties

• Density: 1.477g/cm³ (Cal.)
• Boiling point: 645.306°C at 760 mmHg (Cal.)
• Flash point: 344.069°C (Cal.)