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CS-W001157 4
Total: USD 88.00

Ethyl 3-iodo-4-methylbenzoate

  • CAS No. 859212-59-2

  • Cat. No. CS-0315534
  • Molecule weight290.10
  • Purity95+%
  • MDL No.None

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

Ethyl 3-iodo-4-methylbenzoate|CS-0315534

Structure of 859212-59-2

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General Information

  • CAS No. 859212-59-2
  • Cat. No. CS-0315534
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁IO₂
  • Molecular Weight 290.10
  • Synonym(s) Benzoic acid, 3-iodo-4-methyl-, ethyl ester
  • SMILES CCOC(=O)C1=CC(=C(C)C=C1)I

Synthesis

  • Route1

    References

    • Elliott, Erin L.; Ray, Christian R.; Kraft, Stefan; Atkins, Joseph R.; Moore, Jeffrey S. Journal of Organic Chemistry, 2006 , vol. 71, # 14 p. 5282 - 5290

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.77632
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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