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CS-W001157 4
Total: USD 88.00

p-Tolylacetic acid

  • CAS No. 622-47-9

  • Cat. No. CS-W008979
  • Purity≥98%
  • MDL No.MFCD00004353

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

p-Tolylacetic acid|CS-W008979

Structure of 622-47-9

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General Information

  • CAS No. 622-47-9
  • Cat. No. CS-W008979
  • Purity ≥98%
  • MDL No. MFCD00004353
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀O₂
  • Molecular Weight 150.17
  • Synonym(s) 2-p-Tolylacetic acid; 4-Methylbenzeneacetic acid; 4-Tolylacetic acid; NSC 65595; p-Methylphenylacetic acid; P-tolyacetic acid
  • SMILES O=C(O)CC1=CC=C(C)C=C1

Description

p-Tolylacetic acid features a para-methyl-substituted phenyl ring attached to a carboxylic acid-bearing acetic acid chain. This structure imparts enhanced lipophilicity and steric bulk, enabling efficient integration into synthetic scaffolds requiring aromatic stability and controlled solubility. The compound serves as a valuable building block in medicinal chemistry and materials science applications.

Safety Information

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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

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   1.62212
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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