2-Methyl-2-Propanyl (2-Iodo-4-Methoxyphenyl)Carbamate
[CAS# 157496-75-8]

Identification

• Name: 2-Methyl-2-Propanyl (2-Iodo-4-Methoxyphenyl)Carbamate
• Synonyms: tert-butyl 2-iodo-4-methoxyphenylcarbamate; AI-942/42302123; ZINC00334580
• Molecular Formula: C₁₂H₁₆INO₃
• Molecular Weight: 349.16
• CAS Registry Number: 157496-75-8
• SMILES: CC(C)(C)OC(=O)NC1=C(C=C(C=C1)OC)I
• InChI: 1S/C12H16INO3/c1-12(2,3)17-11(15)14-10-6-5-8(16-4)7-9(10)13/h5-7H,1-4H3,(H,14,15)
• InChIKey: QVVBFDVJTIYVAU-UHFFFAOYSA-N

Properties

• Density: 1.6±0.1g/cm³ (Cal.)
• Boiling point: 341.8±32.0°C at 760 mmHg (Cal.)
• Flash point: 160.5±25.1°C (Cal.)
• Refractive index: 1.59 (Cal.)

References

• (1): Dimitrios E. Lizos and John A. Murphy. Concise synthesis of (±)-horsfiline and (±)-coerulescine by tandem cyclisation of iodoaryl alkenyl azides, Org. Biomol. Chem., 2003, 1, 117.