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CS-W001157 4
Total: USD 88.00

4-Methyl-1-phenylpentan-3-one

  • CAS No. 40463-09-0

  • Cat. No. CS-0250134
  • Molecule weight176.25
  • Purity≥95%
  • MDL No.None

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

4-Methyl-1-phenylpentan-3-one|CS-0250134

Structure of 40463-09-0

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General Information

  • CAS No. 40463-09-0
  • Cat. No. CS-0250134
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆O
  • Molecular Weight 176.25
  • Synonym(s) 4-Methyl-1-phenyl-3-pentanone
  • SMILES CC(C)C(CCC1=CC=CC=C1)=O

Synthesis

  • Route1
    • null|null
      3160-32-5
    • ~90%
    • 4-Methyl-1-phenylpentan-3-one|CS-0250134
      40463-09-0

    References

    • Kotani, Shunsuke; Osakama, Kazuki; Sugiura, Masaharu; Nakajima, Makoto Organic Letters, 2011 , vol. 13, # 15 p. 3968 - 3971
  • Route2

    References

    • Cho, Chan Sik; Kim, Bok Tae; Kim, Tae-Jeong; Chul Shim, Sang Tetrahedron Letters, 2002 , vol. 43, # 44 p. 7987 - 7989
  • Route3
    • null|null
      3277-89-2
    • null|null
      25179-23-1
    • ~87%
    • 4-Methyl-1-phenylpentan-3-one|CS-0250134
      40463-09-0

    References

    • Fujisawa, Tamotsu; Mori, Toshiki; Sato, Toshio Tetrahedron Letters, 1982 , vol. 23, # 48 p. 5059 - 5062

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅰ
Hazard Statements : H310-H315-H319
Precautionary Statements : P262-P264-P270-P280-P302+P352-P305+P351+P338-P361+P364-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.8443
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   4

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