(1aR,1bS,2R,5S,5aR,6S,6aS)-rel-2,3,4,5,6,6a,7,7-Octachloro-1a,1b,5,5a,6,6alpha-Hexahydro-2,5-Methano-2H-Indeno[1,2-b]Oxirene
[CAS 27304-13-8]

Identification

• Classification: Analytical chemistry >> Standard >> Standard material
• Name: (1aR,1bS,2R,5S,5aR,6S,6aS)-rel-2,3,4,5,6,6a,7,7-Octachloro-1a,1b,5,5a,6,6alpha-Hexahydro-2,5-Methano-2H-Indeno[1,2-b]Oxirene
• Synonyms: 2,5-Methano-2H-Indeno[1,2-B]Oxirene, 2,3,4,5,6,6A,7,7-Octachloro-1A,1B,5,5A,6,6A-Hexahydro-, (1A.Alpha.,1B.Beta.,2.Alpha.,5.Alpha.,5A.Beta.,6.Beta.,6A.Alpha.)-; 1-Exo,2-Endo,4,5,6,7,8,8-Octachloro-2,3-Exo-Epoxy-2,3,3A,4,7,7A-Hexahydro-4,7-Methanoindene; 2,5-Methano-2H-Indeno(1,2-B)Oxirene, 2,3,4,5,6,6A,7,7-Octachloro-1A,1B,5,5A,6,6A-Hexahydro-
• Molecular Formula: C₁₀H₄Cl₈O
• Molecular Weight: 423.77
• CAS Registry Number: 27304-13-8
• SMILES: C2(Cl)C1C4(Cl)C(Cl)(Cl)C(Cl)(C1C3OC23Cl)C(=C4Cl)Cl
• InChI: 1S/C10H4Cl8O/c11-3-1-2(6-9(3,16)19-6)8(15)5(13)4(12)7(1,14)10(8,17)18/h1-3,6H
• InChIKey: VWGNQYSIWFHEQU-UHFFFAOYSA-N

Properties

• Density: 1.978g/cm³ (Cal.)
• Boiling point: 442.254°C at 760 mmHg (Cal.)
• Flash point: 165.112°C (Cal.)

References

• (1): Jo Ellen Hinck, Christopher J. Schmitt, Mark R. Ellersieck and Donald E. Tillitt. Relations between and among contaminant concentrations and biomarkers in black bass (Micropterus spp.) and common carp (Cyprinus carpio) from large U.S. rivers, 1995–2004, J. Environ. Monit., 2008, 10, 1499.