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CS-W001157 4
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4-Iodo-3-methylbenzoic acid

  • CAS No. 52107-87-6

  • Cat. No. CS-0099438
  • Purity≥97%
  • MDL No.MFCD00270113

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

4-Iodo-3-methylbenzoic acid|CS-0099438

Structure of 52107-87-6

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General Information

  • CAS No. 52107-87-6
  • Cat. No. CS-0099438
  • Purity ≥97%
  • MDL No. MFCD00270113
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇IO₂
  • Molecular Weight 262.04
  • Synonym(s) None
  • SMILES O=C(O)C1=CC=C(I)C(C)=C1

Synthesis

  • Route1

    References

    • C.I.R.D. Galderma Patent: US5723499 A1, 1998 ;
  • Route2

    References

    • Parik, Patrik; Kulhanek, Jiri; Ludwig, Miroslav; Wagner, Roman; Rotrekl, Ivan; Drahonovsky, Dusan; Meca, Ludek; Smidkova, Marketa; Tobrman, Tomas; Dvorak, Dalimil Organometallics, 2010 , vol. 29, # 18 p. 4135 - 4138
  • Route3
    • 1-(4-Iodo-3-methylphenyl)ethanone|CS-0757765
      52107-80-9
    • ~%
    • In-stock
      4-Iodo-3-methylbenzoic acid|CS-0099438
      52107-87-6

    References

    • Sato Bulletin of the Chemical Society of Japan, 1959 , vol. 32, p. 1130

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-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.29782
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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