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CS-W001157 4
Total: USD 88.00

Mesityl 2,4,6-trimethylbenzoate

  • CAS No. 1504-38-7

  • Cat. No. CS-0582990
  • Molecule weight282.38
  • Purity≥98%
  • MDL No.None

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

Mesityl 2,4,6-trimethylbenzoate|CS-0582990

Structure of 1504-38-7

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General Information

  • CAS No. 1504-38-7
  • Cat. No. CS-0582990
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₉H₂₂O₂
  • Molecular Weight 282.38
  • Synonym(s) Benzoic acid, 2,4,6-trimethyl-, 2,4,6-trimethylphenyl ester
  • SMILES CC1=CC(=C(C(=C1)C)C(=O)OC2=C(C=C(C=C2C)C)C)C

Synthesis

  • Route1
    • null|null
      61080-14-6
    • ~23%
    • Dimesitylmethanone|CS-1179263
      5623-45-0
    • Mesityl 2,4,6-trimethylbenzoate|CS-0582990
      1504-38-7
    • null|null
      161807-01-8

    References

    • Kirschfeld, Andreas; Muthusamy, Sengodagounder; Sander, Wolfram Angewandte Chemie, 1994 , vol. 106, # 21 p. 2261 - 2263
  • Route2

    References

    • Kim, Sunggak; Lee, Jae In Journal of Organic Chemistry, 1984 , vol. 49, # 10 p. 1712 - 1716
  • Route3
    • null|null
      161807-01-8
    • ~%
    • Mesityl 2,4,6-trimethylbenzoate|CS-0582990
      1504-38-7

    References

    • Sander, Wolfram; Schroeder, Kerstin; Muthusamy, Sengodagounder; Kirschfeld, Andreas; Kappert, Wilhelm; Boese, Roland; Kraka, Elfi; Sosa, Carlos; Cremer, Dieter Journal of the American Chemical Society, 1997 , vol. 119, # 31 p. 7265 - 7270

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

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   4.75632
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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