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CS-W001157 4
Total: USD 88.00

Diethyl 5-hydroxyisophthalate

  • CAS No. 39630-68-7

  • Cat. No. CS-0151778
  • Purity95+%
  • MDL No.MFCD00183535

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

Diethyl 5-hydroxyisophthalate|CS-0151778

Structure of 39630-68-7

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General Information

  • CAS No. 39630-68-7
  • Cat. No. CS-0151778
  • Purity 95+%
  • MDL No. MFCD00183535
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₄O₅
  • Molecular Weight 238.24
  • Synonym(s) 5-HYDROXY-ISOPHTHALIC ACID DIETHYL ESTER
  • SMILES CCOC(=O)C1=CC(=CC(=C1)O)C(=O)OCC

Synthesis

  • Route1

    References

    • Zhang, San-Qi; Fukase, Koichi; Izumi, Minoru; Fukase, Yoshiyuki; Kusumoto, Shoichi Synlett, 2001 , # 5 p. 590 - 596
  • Route2

    References

    • Cunliffe, Denise; Leason, Mark; Parkin, Donald; Lea, Peter J. Phytochemistry (Elsevier), 1983 , vol. 22, # 6 p. 1357 - 1360

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

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Computational Chemistry Data

  • TPSA   72.83
  • LogP   1.7456
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   4

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