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2-Hydroxy-4,5-dimethylbenzoic acid

  • CAS No. 58138-52-6

  • Cat. No. CS-0566920
  • Molecule weight166.17
  • Purity≥98%
  • MDL No.MFCD12196123

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

2-Hydroxy-4,5-dimethylbenzoic acid|CS-0566920

Structure of 58138-52-6

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General Information

  • CAS No. 58138-52-6
  • Cat. No. CS-0566920
  • Purity ≥98%
  • MDL No. MFCD12196123
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀O₃
  • Molecular Weight 166.17
  • Synonym(s) 4,5-Dimethylsalicylic acid
  • SMILES O=C(C1=C(O)C=C(C)C(C)=C1)O

Synthesis

  • Route1

    References

    • Zhang, Yang-Hui; Yu, Jin-Quan Journal of the American Chemical Society, 2009 , vol. 131, # 41 p. 14654 - 14655
  • Route2
    • null|null
      95-65-8
    • ~%
    • 2-Hydroxy-4,5-dimethylbenzoic acid|CS-0566920
      58138-52-6

    References

    • Schmitt; Dinh An Poupelin; et al. Synthesis, 1984 , vol. NO. 9, p. 758 - 760
  • Route3
    • 2-Hydroxy-2-(2-hydroxy-4,5-dimethylphenyl)-1H-indene-1,3(2H)-dione|CS-0365259
      71321-29-4
    • ~%
    • 2-Hydroxy-4,5-dimethylbenzoic acid|CS-0566920
      58138-52-6

    References

    • Schmitt; Dinh An Poupelin; et al. Synthesis, 1984 , vol. NO. 9, p. 758 - 760

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H319
Precautionary Statements : P264-P264-P270-P270-P280

Quality Control

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   1.70724
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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