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CS-W001157 4
Total: USD 88.00

4-Methoxy-2-methylbenzoic acid

  • CAS No. 6245-57-4

  • Cat. No. CS-W007937
  • Molecule weight166.17
  • Purity≥98%
  • MDL No.MFCD00020291

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

4-Methoxy-2-methylbenzoic acid|CS-W007937

Structure of 6245-57-4

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General Information

  • CAS No. 6245-57-4
  • Cat. No. CS-W007937
  • Purity ≥98%
  • MDL No. MFCD00020291
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀O₃
  • Molecular Weight 166.17
  • Synonym(s) Benzoic acid, 4-methoxy-2-methyl-
  • SMILES O=C(O)C1=CC=C(OC)C=C1C

Synthesis

  • Route1
    • null|null
      124-38-9
    • ~%
    • In-stock
      4-Methoxy-2-methylbenzoic acid|CS-W007937
      6245-57-4

    References

    • WO2006/76246 A2, ; Page/Page column 147 ; WO 2006/076246 A2
  • Route2
    • null|null
      124-38-9
    • In-stock
      2-Bromo-5-methoxytoluene|CS-W001186
      27060-75-9
    • ~99%
    • In-stock
      4-Methoxy-2-methylbenzoic acid|CS-W007937
      6245-57-4

    References

    • Lehmann, Fredrik; Currier, Erika A.; Olsson, Roger; Ma, Jian-Nong; Burstein, Ethan S.; Hacksell, Uli; Luthman, Kristina Bioorganic and Medicinal Chemistry, 2010 , vol. 18, # 13 p. 4844 - 4854
  • Route3

    References

    • Hauser, Frank M.; Ellenberger, Suzanne R. Synthesis, 1987 , # 8 p. 723 - 724

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   1.70182
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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