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CS-W001157 4
Total: USD 88.00

4-(2,5-Dimethylphenyl)butanoic acid

  • CAS No. 1453-06-1

  • Cat. No. CS-0233639
  • Purity95+%
  • MDL No.None

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

4-(2,5-Dimethylphenyl)butanoic acid|CS-0233639

Structure of 1453-06-1

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General Information

  • CAS No. 1453-06-1
  • Cat. No. CS-0233639
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆O₂
  • Molecular Weight 192.25
  • Synonym(s) Butyric acid,5-xylyl)
  • SMILES CC1=CC(=C(C)C=C1)CCCC(=O)O

Synthesis

  • Route1

    References

    • Boberg, Friedrich; Jachiewicz, Adam; Garming, Alfons Phosphorus, Sulfur and Silicon and the Related Elements, 1992 , vol. 72, # 1-4 p. 1 - 12
  • Route2
    • 4-Chlorobutanoic acid Levetiracetam Impurity|CS-0213997
      627-00-9
    • null|null
      106-42-3
    • ~90%
    • 4-(2,5-Dimethylphenyl)butanoic acid|CS-0233639
      1453-06-1

    References

    • Banerjee, Ajoy K.; Vera, William; Laya, Manuel S. Synthetic Communications, 2004 , vol. 34, # 12 p. 2301 - 2308
  • Route3
    • null|null
      96-48-0
    • null|null
      106-42-3
    • ~%
    • 4-(2,5-Dimethylphenyl)butanoic acid|CS-0233639
      1453-06-1

    References

    • Christiaens,L.; Renson,M. Bulletin des Societes Chimiques Belges, 1969 , vol. 78, p. 359 - 393

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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.71074
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   4

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