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CS-W001157 4
Total: USD 88.00

1-(4-(3-Bromopropyl)phenyl)ethanone

  • CAS No. 41996-96-7

  • Cat. No. CS-0459891
  • Purity≥98%
  • MDL No.None

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

1-(4-(3-Bromopropyl)phenyl)ethanone|CS-0459891

Structure of 41996-96-7

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General Information

  • CAS No. 41996-96-7
  • Cat. No. CS-0459891
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃BrO
  • Molecular Weight 241.12
  • Synonym(s) 1-(4-Acetylphenyl)-3-bromopropane
  • SMILES CC(C1=CC=C(CCCBr)C=C1)=O

Synthesis

  • Route1

    References

    • Garcia-Moreno; Costela; Campo; Sastre; Amat-Guerri; Liras; Lopez Arbeloa; Banuelos Prieto Journal of Physical Chemistry A, 2004 , vol. 108, # 16 p. 3315 - 3323
  • Route2
    • null|null
      134836-71-8
    • ~78%
    • 1-(4-(3-Bromopropyl)phenyl)ethanone|CS-0459891
      41996-96-7

    References

    • Li, Xiao-Qiang; Wang, Wei-Kun; Han, Yi-Xin; Zhang, Chi Advanced Synthesis and Catalysis, 2010 , vol. 352, # 14-15 p. 2588 - 2598
  • Route3

    References

    • Shen, Zhi-Liang; Goh, Kelvin Kau Kiat; Yang, Yong-Sheng; Lai, Yin-Chang; Wong, Colin Hong An; Cheong, Hao-Lun; Loh, Teck-Peng Angewandte Chemie - International Edition, 2011 , vol. 50, # 2 p. 511 - 514

Safety Information

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GHS Pictogram : N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   3.2167
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   4

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