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CS-W001157 4
Total: USD 88.00

3,5-Bis(ethoxycarbonyl)benzoate

  • CAS No. 4105-93-5

  • Cat. No. CS-0581254
  • Purity≥98%
  • MDL No.None

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

3,5-Bis(ethoxycarbonyl)benzoate|CS-0581254

Structure of 4105-93-5

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General Information

  • CAS No. 4105-93-5
  • Cat. No. CS-0581254
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₃O₆-
  • Molecular Weight 265.24
  • Synonym(s) DIETHYL 5-CARBOXY-ISOPHTHALATE
  • SMILES CCOC(=O)C1=CC(=CC(=C1)C(=O)[O-])C(=O)OCC

Synthesis

  • Route1

    References

    • Bhosale, Sheshanath V.; Kalyankar, Mohan B.; Langibrd, Steven J.; Bhosale, Sidhanath V.; Oliver, Ruth F. European Journal of Organic Chemistry, 2009 , # 24 p. 4128 - 4134

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   92.73
  • LogP   0.4035
  • H_Acceptors   6
  • H_Donors   0
  • Rotatable_Bonds   5

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