N-(2-(4-Hydroxyphenyl)Ethyl)-2-Iodo-Acetamide
[CAS# 53527-07-4]

Identification

• Name: N-(2-(4-Hydroxyphenyl)Ethyl)-2-Iodo-Acetamide
• Synonyms: N-[2-(4-Hydroxyphenyl)Ethyl]-2-Iodo-Acetamide; N-[2-(4-Hydroxyphenyl)Ethyl]-2-Iodo-Ethanamide; Acetamide, N-(2-(4-Hydroxyphenyl)Ethyl)-2-Iodo-
• Molecular Formula: C₁₀H₁₂INO₂
• Molecular Weight: 305.11
• CAS Registry Number: 53527-07-4
• SMILES: C1=CC(=CC=C1CCNC(CI)=O)O
• InChI: 1S/C10H12INO2/c11-7-10(14)12-6-5-8-1-3-9(13)4-2-8/h1-4,13H,5-7H2,(H,12,14)
• InChIKey: KROHFNRTQBLLOZ-UHFFFAOYSA-N

Properties

• Density: 1.71g/cm³ (Cal.)
• Boiling point: 483.457°C at 760 mmHg (Cal.)
• Flash point: 246.186°C (Cal.)

References

• (1): Philip Prathipati, Ngai Ling Ma* and Thomas H. Keller. Global Bayesian Models for the Prioritization of Antitubercular Agents, J. Chem. Inf. Model., 2008, 48 (12), pp 2362–2370