(3R,4S,5S,6R)-1,3,4,5,6-Pentachlorocyclohexene
[CAS# 319-94-8]

Identification

• Name: (3R,4S,5S,6R)-1,3,4,5,6-Pentachlorocyclohexene
• Synonyms: C06596; Gamma-Pentachlorocyclohexene; 1,3(R),4(S),5(S),6(R)-Pentachlorocyclohexene
• Molecular Formula: C₆H₅Cl₅
• Molecular Weight: 254.37
• CAS Registry Number: 319-94-8
• SMILES: [C@H]1(Cl)[C@@H](Cl)[C@H](Cl)C=C(Cl)[C@@H]1Cl
• InChI: 1S/C6H5Cl5/c7-2-1-3(8)5(10)6(11)4(2)9/h1-2,4-6H/t2-,4+,5+,6+/m1/s1
• InChIKey: MQYAVRUCONBHOR-JSTMLOLSSA-N

Properties

• Density: 1.561g/cm³ (Cal.)
• Boiling point: 306.708°C at 760 mmHg (Cal.)
• Flash point: 145.538°C (Cal.)