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CS-W001157 4
Total: USD 88.00

2-(4-Hydroxyphenyl)-3-methylbutanoic acid

  • CAS No. 70124-98-0

  • Cat. No. CS-0523748
  • Molecule weight194.23
  • Purity≥98%
  • MDL No.None

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

2-(4-Hydroxyphenyl)-3-methylbutanoic acid|CS-0523748

Structure of 70124-98-0

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General Information

  • CAS No. 70124-98-0
  • Cat. No. CS-0523748
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄O₃
  • Molecular Weight 194.23
  • Synonym(s) 2-(4-Hydroxyphenyl)-3-methylbutyric acid
  • SMILES CC(C)C(C1=CC=C(O)C=C1)C(O)=O

Synthesis

  • Route1
    • null|null
      67033-46-9
    • ~94%
    • 2-(4-Hydroxyphenyl)-3-methylbutanoic acid|CS-0523748
      70124-98-0

    References

    • Ethyl Corporation Patent: US4405528 A1, 1983 ;
  • Route2
    • 2-(4-Chlorophenyl)-3-methylbutanenitrile|CS-0731961
      2012-81-9
    • ~%
    • 2-(4-Hydroxyphenyl)-3-methylbutanoic acid|CS-0523748
      70124-98-0

    References

    • American Cyanamid Company Patent: US4537988 A1, 1985 ;
  • Route3
    • null|null
      51632-18-9
    • ~%
    • 2-(4-Hydroxyphenyl)-3-methylbutanoic acid|CS-0523748
      70124-98-0

    References

    • American Cyanamid Company Patent: US4377531 A1, 1983 ;

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   2.2164
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   3

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