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CS-W001157 4
Total: USD 88.00

2-(4-(Benzyloxy)-3-hydroxyphenyl)acetic acid

  • CAS No. 28988-68-3

  • Cat. No. CS-0069612
  • Molecule weight258.27
  • Purity≥98%
  • MDL No.MFCD16293773

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

2-(4-(Benzyloxy)-3-hydroxyphenyl)acetic acid|CS-0069612

Structure of 28988-68-3

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General Information

  • CAS No. 28988-68-3
  • Cat. No. CS-0069612
  • Purity ≥98%
  • MDL No. MFCD16293773
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₁₄O₄
  • Molecular Weight 258.27
  • Synonym(s) 4-Benzyloxy-3-hydroxyphenylacetic acid
  • SMILES O=C(O)CC1=CC=C(OCC2=CC=CC=C2)C(O)=C1

Synthesis

  • Route1
    • methyl 2-(4-(benzyloxy)-3-bromophenyl)acetate|CS-1006827
      101111-25-5
    • ~54%
    • In-stock
      2-(4-(Benzyloxy)-3-hydroxyphenyl)acetic acid|CS-0069612
      28988-68-3

    References

    • Sun, Haifeng; Zhu, Liyuan; Yang, Huicui; Qian, Wangke; Guo, Lin; Zhou, Shengbin; Gao, Bo; Li, Zeng; Zhou, Yu; Jiang, Hualiang; Chen, Kaixian; Zhen, Xuechu; Liu, Hong Bioorganic and Medicinal Chemistry, 2013 , vol. 21, # 4 p. 856 - 868
  • Route2

    References

    • SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES; LIU, Hong; XIE, Xin; ZHEN, Xuechu; SUN, Haifeng; LI, Jing; ZHU, Liyuan; LI, Zeng; CHEN, Ying; JIANG, Hualiang; CHEN, Kaixian Patent: US2014/88130 A1, 2014 ;
  • Route3

    References

    • SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES; LIU, Hong; XIE, Xin; ZHEN, Xuechu; SUN, Haifeng; LI, Jing; ZHU, Liyuan; LI, Zeng; CHEN, Ying; JIANG, Hualiang; CHEN, Kaixian Patent: US2014/88130 A1, 2014 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   66.76
  • LogP   2.5983
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   5

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