CAS 53494-70-5 Endrin-ketone - Analytical Products / Alfa Chemistry

CAT	APS53494705
CAS	53494-70-5
Structure
Synonyms	2,5,7-Metheno-3H-cyclopenta[a]pentalen-3-one, 3b,4,5,6,6,6a-hexachlorodecahydro-, (2R,3aR,3bS,4R,5R,6aS,7S,7aS,8R)-rel-, SD 2614, Endrin ketone, δ-Ketoendrin, 2,5,7-Metheno-3H-cyclopenta[a]pentalen-3-one, 3b,4,5,6,6,6a-hexachlorodecahydro-, (2α,3aβ,3bβ,4β,5β,6aβ,7α,7aβ,8R*)-, rel-(2R,3aR,3bS,4R,5R,6aS,7S,7aS,8R)-3b,4,5,6,6,6a-Hexachlorodecahydro-2,5,7-metheno-3H-cyclopenta[a]pentalen-3-one
IUPAC Name	rel-(2R,3aR,3bS,4R,5R,6aS,7S,7aS,8R)-3b,4,5,6,6,6a-Hexachlorodecahydro-2,5,7-metheno-3H-cyclopenta[a]pentalen-3-one
Molecular Weight	380.91
Molecular Formula	C12H8Cl6O
Canonical SMILES	Cl[C@H]1[C@]2(Cl)[C@@H]3[C@H]4C[C@H]5[C@@H]3[C@@](Cl)(C2(Cl)Cl)[C@]1(Cl)[C@H]5C4=O
InChI	InChI=1S/C12H8Cl6O/c13-8-9(14)6-2-1-3(7(6)19)4-5(2)11(9,16)12(17,18)10(4,8)15/h2-6,8H,1H2/t2-,3+,4+,5-,6+,8+,9-,10+,11-/m0/s1

Accurate Mass	377.8706
Format	Neat
Product Type	Metabolite
Shipping	Room Temperature
Storage Conditions	+20°C
Subcategory	Insecticides and metabolites, Organochlorine Pesticides