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CS-W001157 4
Total: USD 88.00

4-(2,4,5-Trimethylphenyl)butan-2-one

  • CAS No. 59372-86-0

  • Cat. No. CS-0275920
  • Molecule weight190.28
  • Purity≥98%
  • MDL No.None

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

4-(2,4,5-Trimethylphenyl)butan-2-one|CS-0275920

Structure of 59372-86-0

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General Information

  • CAS No. 59372-86-0
  • Cat. No. CS-0275920
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₈O
  • Molecular Weight 190.28
  • Synonym(s) 2-Butanone, 4-(2,4,5-trimethylphenyl)-
  • SMILES CC(CCC1=CC(C)=C(C)C=C1C)=O

Synthesis

  • Route1
    • null|null
      97023-14-8
    • ~88%
    • 4-(2,4,5-Trimethylphenyl)butan-2-one|CS-0275920
      59372-86-0

    References

    • Nakamura, Mitsuhiro; Mamino, Masashi; Masaki, Mizuki; Maki, Shojiro; Matsui, Ryo; Kojima, Satoshi; Hirano, Takashi; Ohmiya, Yoshihiro; Niwa, Haruki Tetrahedron Letters, 2005 , vol. 46, # 1 p. 53 - 56
  • Route2

    References

    • Nakamura, Mitsuhiro; Mamino, Masashi; Masaki, Mizuki; Maki, Shojiro; Matsui, Ryo; Kojima, Satoshi; Hirano, Takashi; Ohmiya, Yoshihiro; Niwa, Haruki Tetrahedron Letters, 2005 , vol. 46, # 1 p. 53 - 56
  • Route3
    • null|null
      95-63-6
    • ~%
    • 4-(2,4,5-Trimethylphenyl)butan-2-one|CS-0275920
      59372-86-0

    References

    • John; Guenther Chemische Berichte, 1941 , vol. 74, p. 879,885

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   3.13346
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   3

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