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CS-W001157 4
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2-[(Pyrrolidin-1-yl)carbonyl]benzoic acid

  • CAS No. 20320-43-8

  • Cat. No. CS-0207256
  • Molecule weight219.24
  • Purity≥98%
  • MDL No.MFCD01961578

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

2-[(Pyrrolidin-1-yl)carbonyl]benzoic acid|CS-0207256

Structure of 20320-43-8

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General Information

  • CAS No. 20320-43-8
  • Cat. No. CS-0207256
  • Purity ≥98%
  • MDL No. MFCD01961578
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃NO₃
  • Molecular Weight 219.24
  • Synonym(s) 2-(Pyrrolidine-1-carbonyl)benzoic acid
  • SMILES C1=CC=C(C(=C1)C(=O)N2CCCC2)C(=O)O

Synthesis

  • Route1
    • null|null
      123-75-1
    • null|null
      85-44-9
    • ~77%
    • 2-[(Pyrrolidin-1-yl)carbonyl]benzoic acid|CS-0207256
      20320-43-8

    References

    • Sato, Ippei; Morihira, Koichiro; Inami, Hiroshi; Kubota, Hirokazu; Morokata, Tatsuaki; Suzuki, Keiko; Iura, Yosuke; Nitta, Aiko; Imaoka, Takayuki; Takahashi, Toshiya; Takeuchi, Makoto; Ohta, Mitsuaki; Tsukamoto, Shin-ichi Bioorganic and Medicinal Chemistry, 2008 , vol. 16, # 18 p. 8607 - 8618

Safety Information

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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

Quality Control

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Computational Chemistry Data

  • TPSA   57.61
  • LogP   1.6208
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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