1-Iodocyclohexene
[CAS# 17497-53-9]

Identification

• Name: 1-Iodocyclohexene
• Synonyms: 1-Iodo-1-cyclohexene; 1-Iodocyclohex-1-ene
• Molecular Formula: C₆H₉I
• Molecular Weight: 208.04
• CAS Registry Number: 17497-53-9
• SMILES: I\C1=C\CCCC1
• InChI: 1S/C6H9I/c7-6-4-2-1-3-5-6/h4H,1-3,5H2
• InChIKey: CAROGICRCNKEOD-UHFFFAOYSA-N

Properties

• Density: 1.705g/cm³ (Cal.)
• Boiling point: 187.317°C at 760 mmHg (Cal.)
• Flash point: 76.824°C (Cal.)
• Refractive index: 1.576 (Cal.)

References

• (1): Natalie A. Miller, Anthony C. WillisTo whom correspondence should be addressed regarding the X-ray crystal structures. E-mail: willis@rsc.anu.edu.au. and Michael S. Sherburn. Formal total synthesis of triptolide, Chem. Commun., 2008, 1226.