(1S,2S,3R,4S,5S,6R)-1,2,3,4,5-Pentachloro-7-Oxabicyclo[4.1.0]Heptane
[CAS# 93672-46-9]

Identification

• Name: (1S,2S,3R,4S,5S,6R)-1,2,3,4,5-Pentachloro-7-Oxabicyclo[4.1.0]Heptane
• Synonyms: 1,3,4,5,6-Pentachlorocyclohexene-1-Oxide; 7-Oxabicyclo(4.1.0)Heptane, 1,2,3,4,5-Pentachloro-, (1Alpha,2Beta,3Alpha,4Beta,5Beta,6Alpha)-
• Molecular Formula: C₆H₅Cl₅O
• Molecular Weight: 270.37
• CAS Registry Number: 93672-46-9
• SMILES: [C@@]12([C@H]([C@@H]([C@H]([C@H]([C@H]1O2)Cl)Cl)Cl)Cl)Cl
• InChI: 1S/C6H5Cl5O/c7-1-2(8)4(10)6(11)5(12-6)3(1)9/h1-5H/t1-,2-,3-,4+,5-,6+/m1/s1
• InChIKey: BHHXTWQURUPAAI-GTTIYYRPSA-N

Properties

• Density: 1.708g/cm³ (Cal.)
• Boiling point: 347.001°C at 760 mmHg (Cal.)
• Flash point: 145.913°C (Cal.)