Ethyl (2Z)-3-Iodo-2-Butenoate
[CAS# 34450-62-9]

Identification

• Name: Ethyl (2Z)-3-Iodo-2-Butenoate
• Synonyms: (Z)-ethyl 3-iodobut-2-enoate
• Molecular Formula: C₆H₉IO₂
• Molecular Weight: 240.04
• CAS Registry Number: 34450-62-9
• SMILES: CCOC(=O)/C=C(/C)\I
• InChI: 1S/C6H9IO2/c1-3-9-6(8)4-5(2)7/h4H,3H2,1-2H3/b5-4-
• InChIKey: LTFHTHBCTYXEAD-PLNGDYQASA-N

Properties

• Density: 1.675g/cm³ (Cal.)
• Boiling point: 214.099°C at 760 mmHg (Cal.)
• Flash point: 83.285°C (Cal.)

References

• (1): Miller David J.. Competitive inhibition of aristolochene synthase by phenyl-substituted farnesyl diphosphates: evidence of active site plasticity, Organic & Biomolecular Chemistry, 2007