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(3-Iodophenyl)methanamine

  • CAS No. 696-40-2

  • Cat. No. CS-0173474
  • Molecule weight233.05
  • Purity≥95%
  • MDL No.MFCD00192227

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

(3-Iodophenyl)methanamine|CS-0173474

Structure of 696-40-2

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General Information

  • CAS No. 696-40-2
  • Cat. No. CS-0173474
  • Purity ≥95%
  • MDL No. MFCD00192227
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈IN
  • Molecular Weight 233.05
  • Synonym(s) meta-Iodobenzylamine
  • SMILES NCC1=CC=CC(I)=C1

Description

(3-Iodophenyl)methanamine is a bench-stable, electron-deficient arylalkylamine featuring a para-iodinated phenyl ring that enables efficient coupling in cross-coupling transformations. This building block integrates readily into pharmaceutical scaffolds and functional materials, offering high reactivity under standard conditions with minimal side-product formation.

Synthesis

  • Route1

    References

    • Haddenham, Dustin; Pasumansky, Lubov; DeSoto, Jamie; Eagon, Scott; Singaram, Bakthan Journal of Organic Chemistry, 2009 , vol. 74, # 5 p. 1964 - 1970
  • Route2

    References

    • Erdelyi, Mate; Varedian, Miranda; Skoeld, Christian; Niklasson, Ida B.; Nurbo, Johanna; Persson, Asa; Bergquist, Jonas; Gogoll, Adolf Organic and Biomolecular Chemistry, 2008 , vol. 6, # 23 p. 4356 - 4373
  • Route3
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      200706-60-1
    • ~%
    • In-stock
      (3-Iodophenyl)methanamine|CS-0173474
      696-40-2

    References

    • Journal of the Chemical Society, , p. 696,703

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS08
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H317-H319-H334-H335-H361
Precautionary Statements : P201-P280-P302+P352-P305+P351+P338-P308+P313

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   1.7499
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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