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5-Oxo-1-[4-(propan-2-yl)phenyl]pyrrolidine-3-carboxylic acid

  • CAS No. 63674-51-1

  • Cat. No. CS-0123228
  • Purity≥98%
  • MDL No.MFCD02197521

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

5-Oxo-1-[4-(propan-2-yl)phenyl]pyrrolidine-3-carboxylic acid|CS-0123228

Structure of 63674-51-1

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General Information

  • CAS No. 63674-51-1
  • Cat. No. CS-0123228
  • Purity ≥98%
  • MDL No. MFCD02197521
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₇NO₃
  • Molecular Weight 247.29
  • Synonym(s) 1-(4-Isopropylphenyl)-5-oxopyrrolidine-3-carboxylic acid
  • SMILES O=C(C(C1)CN(C2=CC=C(C(C)C)C=C2)C1=O)O

Synthesis

  • Route1

    References

    • Watanabe, S.; Ogawa, K.; Ohno, T.; Yano, S.; Yamada, H.; Shirasaka, T. European Journal of Medicinal Chemistry, 1994 , vol. 29, # 9 p. 675 - 686

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P363-P501

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Computational Chemistry Data

  • TPSA   57.61
  • LogP   2.2475
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   3

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