1,3,4,7,8,9,10,10-Octachlorotricyclo[5.2.1.0(2,6)]dec-8-ene
[CAS 12789-03-6]

Identification

• Classification: Analytical chemistry >> Standard >> Cosmetic standard
• Name: 1,3,4,7,8,9,10,10-Octachlorotricyclo[5.2.1.0(2,6)]dec-8-ene
• Synonyms: Chebi:34623; 1,2,4,5,6,7,8,8-Octachloro-2,3,3A,4,7,7A-Hexahydro-1H-4,7-Methanoindene; (1Alpha,2Alpha,3Aalpha,4Beta,7Beta,7Aalpha)-1,2,4,5,6,7,8,8-Octachloro-2,3,3A,4,7,7A-Hexahydro-4,7-Methano-1H-Indene
• Molecular Formula: C₁₀H₆Cl₈
• Molecular Weight: 409.78
• CAS Registry Number: 12789-03-6 (33442-85-2)
• SMILES: C3C1C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(Cl)C3Cl
• InChI: 1S/C10H6Cl8/c11-3-1-2-4(5(3)12)9(16)7(14)6(13)8(2,15)10(9,17)18/h2-5H,1H2
• InChIKey: BIWJNBZANLAXMG-UHFFFAOYSA-N

Properties

• Density: 1.8±0.1g/cm³ (Cal.)
• Melting point: 106-107°C (Expl.)
• Boiling point: 175°C (Expl.)
• Flash point: 212.5±24.7°C (Cal.)
• solubility: 0.0001%

Safety Data

• Safety Description: Safety glasses, gloves, adequate ventilation.

References

• (1): Chubashini Shunthirasingham, Catherine E. Oyiliagu, Xiaoshu Cao, Todd Gouin, Frank Wania, Sum-Chi Lee, Karla Pozo, Tom Harner and Derek C. G. Muir. Spatial and temporal pattern of pesticides in the global atmosphere, J. Environ. Monit., 2010, 12, 1650.