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Dimethyl 2-hydroxyisophthalate

  • CAS No. 36669-06-4

  • Cat. No. CS-0119694
  • Molecule weight210.18
  • Purity≥98%
  • MDL No.None

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

Dimethyl 2-hydroxyisophthalate|CS-0119694

Structure of 36669-06-4

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General Information

  • CAS No. 36669-06-4
  • Cat. No. CS-0119694
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀O₅
  • Molecular Weight 210.18
  • Synonym(s) 1,3-dimethyl 2-hydroxybenzene-1,3-dicarboxylate
  • SMILES O=C(C1=CC=CC(C(OC)=O)=C1O)OC

Synthesis

  • Route1

    References

    • Sankyo Company, Limited Patent: US6555556 B1, 2003 ; US 6555556 B1
  • Route2

    References

    • Graebe; Kraft Chemische Berichte, 1906 , vol. 39, p. 799
  • Route3

    References

    • Bertz, Steven H.; Dabbagh, Gary Angewandte Chemie, 1982 , vol. 94, # 4 p. 317 - 318

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   72.83
  • LogP   0.9654
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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