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CS-W001157 4
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(5-Iodo-2-methylphenyl)methanol

  • CAS No. 1260242-01-0

  • Cat. No. CS-0097689
  • Purity≥95%
  • MDL No.MFCD18397814

*For research and further manufacturing use only, not for direct human use.

(5-Iodo-2-methylphenyl)methanol|CS-0097689

Structure of 1260242-01-0

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General Information

  • CAS No. 1260242-01-0
  • Cat. No. CS-0097689
  • Purity ≥95%
  • MDL No. MFCD18397814
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉IO
  • Molecular Weight 248.06
  • Synonym(s) 5-Iodo-2-methylbenzyl Alcohol
  • SMILES OCC1=CC(I)=CC=C1C

Description

This iodinated benzyl alcohol features a methyl group at the ortho position relative to the hydroxymethyl moiety, enhancing electronic and steric control. The pendant iodine enables direct functionalization via cross-coupling reactions. The molecule exhibits bench-stable handling characteristics under standard conditions and integrates readily into synthetic sequences requiring halogen-directed derivatization.

Application

(5-Iodo-2-methylphenyl)methanol serves as a versatile building block for palladium-catalyzed cross-coupling reactions, enabling efficient construction of biaryl and heteroaryl architectures. Its iodide functionality exhibits high reactivity in standard Suzuki, Stille, and Negishi couplings, while the benzylic alcohol group provides a handle for further derivatization or protection. The molecule demonstrates good bench stability and facilitates straightforward purification, making it well-suited for iterative synthesis in medicinal chemistry and process development workflows.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   2.09192
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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