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CS-W001157 4
Total: USD 88.00

4-(tert-Butyl)-3-methoxybenzoic acid

  • CAS No. 79822-46-1

  • Cat. No. CS-W022030
  • Molecule weight208.25
  • Purity≥98%
  • MDL No.MFCD06656116

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

4-(tert-Butyl)-3-methoxybenzoic acid|CS-W022030

Structure of 79822-46-1

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General Information

  • CAS No. 79822-46-1
  • Cat. No. CS-W022030
  • Purity ≥98%
  • MDL No. MFCD06656116
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆O₃
  • Molecular Weight 208.25
  • Synonym(s) 4-Tert-butyl-3-methoxybenzoic acid
  • SMILES COC1=C(C=CC(=C1)C(O)=O)C(C)(C)C

Synthesis

  • Route1
    • null|null
      88-40-4
    • ~%
    • In-stock
      4-(tert-Butyl)-3-methoxybenzoic acid|CS-W022030
      79822-46-1

    References

    • Journal of Organic Chemistry, , vol. 73, # 8 p. 3094 - 3102
  • Route2
    • null|null
      88-40-4
    • ~%
    • In-stock
      4-(tert-Butyl)-3-methoxybenzoic acid|CS-W022030
      79822-46-1
    • null|null
      71850-79-8

    References

    • Zhurnal Obshchei Khimii, , vol. 16, p. 145,154 Chem.Abstr., , p. 108
  • Route3
    • null|null
      88-40-4
    • null|null
      7697-37-2
    • ~%
    • In-stock
      4-(tert-Butyl)-3-methoxybenzoic acid|CS-W022030
      79822-46-1
    • null|null
      71850-79-8

    References

    • Zhurnal Obshchei Khimii, , vol. 16, p. 145,154 Chem.Abstr., , p. 108

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

Quality Control

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   2.6909
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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