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CS-W001157 4
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(2E)-3-(2H-1,3-Benzodioxol-5-yl)-1-(4-methoxyphenyl)prop-2-en-1-one

  • CAS No. 2373-93-5

  • Cat. No. CS-0123312
  • Purity≥98%
  • MDL No.MFCD00117858

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

(2E)-3-(2H-1,3-Benzodioxol-5-yl)-1-(4-methoxyphenyl)prop-2-en-1-one|CS-0123312

Structure of 2373-93-5

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General Information

  • CAS No. 2373-93-5
  • Cat. No. CS-0123312
  • Purity ≥98%
  • MDL No. MFCD00117858
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₇H₁₄O₄
  • Molecular Weight 282.29
  • Synonym(s) 3-(1,3-Benzodioxol-5-yl)-1-(4-methoxyphenyl)prop-2-en-1-one
  • SMILES O=C(C1=CC=C(OC)C=C1)/C=C/C2=CC=C(OCO3)C3=C2

Synthesis

  • Route1

    References

    • Ellis, James E.; Davis, Edward M.; Dozeman, Gary J.; Lenoir, Edward A.; Belmont, Daniel T.; Brower, Phillip L. Organic Process Research and Development, 2001 , vol. 5, # 3 p. 226 - 233
  • Route2

    References

    • Luo, Yin; Zhang, Shuai; Qiu, Ke-Ming; Liu, Zhi-Jun; Yang, Yu-Shun; Fu, Jie; Zhong, Wei-Qing; Zhu, Hai-Liang Bioorganic and Medicinal Chemistry Letters, 2013 , vol. 23, # 4 p. 1091 - 1095
  • Route3

    References

    • Wang, Hai-Hong; Qiu, Ke-Ming; Cui, Hong-En; Yang, Yu-Shun; Yin-Luo; Xing, Man; Qiu, Xiao-Yang; Bai, Li-Fei; Zhu, Hai-Liang Bioorganic and Medicinal Chemistry, 2013 , vol. 21, # 2 p. 448 - 455

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   44.76
  • LogP   3.32
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   4

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