Cas no 90514-00-4 (2,5-Pyrrolidinedicarboxylic acid, diethyl ester, (2R,5S)-rel-)

2,5-Pyrrolidinedicarboxylic acid, diethyl ester, (2R,5S)-rel-, is a chiral pyrrolidine derivative commonly employed as a versatile intermediate in organic synthesis and pharmaceutical research. The diethyl ester functionality enhances solubility in organic solvents, facilitating its use in esterification and transesterification reactions. The (2R,5S)-rel- configuration provides a stereochemical framework useful for asymmetric synthesis and chiral auxiliary applications. Its rigid pyrrolidine ring structure contributes to stability, making it suitable for constructing complex molecular architectures. This compound is particularly valuable in peptidomimetics and heterocyclic chemistry due to its bifunctional carboxylate groups, enabling selective modifications. High purity and well-defined stereochemistry ensure reproducibility in research and industrial applications.
2,5-Pyrrolidinedicarboxylic acid, diethyl ester, (2R,5S)-rel- structure
90514-00-4 structure
Product Name:2,5-Pyrrolidinedicarboxylic acid, diethyl ester, (2R,5S)-rel-
CAS No:90514-00-4
MF:C10H17NO4
MW:215.24628329277
MDL:MFCD01935388
CID:1951097
PubChem ID:11701306
Update Time:2025-10-14

2,5-Pyrrolidinedicarboxylic acid, diethyl ester, (2R,5S)-rel- Chemical and Physical Properties

Names and Identifiers

    • 2,5-Pyrrolidinedicarboxylic acid, diethyl ester, (2R,5S)-rel-
    • cis-Diethyl pyrrolidine-2,5-dicarboxylate
    • SCHEMBL4521342
    • 90514-00-4
    • EN300-97953
    • 2,5-Diethyl (2R,5S)-pyrrolidine-2,5-dicarboxylate
    • rel-2,5-Diethyl (2R,5S)-pyrrolidine-2,5-dicarboxylate
    • rel-2,5-Diethyl(2R,5S)-pyrrolidine-2,5-dicarboxylate
    • diethyl (2R,5S)-pyrrolidine-2,5-dicarboxylate
    • XDYNGPAGOCWBMK-OCAPTIKFSA-N
    • (+/-)-diethyl (2R,5S)-pyrrolidine-2,5-dicarboxylate
    • MDL: MFCD01935388
    • Inchi: 1S/C10H17NO4/c1-3-14-9(12)7-5-6-8(11-7)10(13)15-4-2/h7-8,11H,3-6H2,1-2H3
    • InChI Key: XDYNGPAGOCWBMK-UHFFFAOYSA-N
    • SMILES: CCOC(C1NC(C(OCC)=O)CC1)=O

Computed Properties

  • Exact Mass: 215.11575802Da
  • Monoisotopic Mass: 215.11575802Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 6
  • Complexity: 218
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.9
  • Topological Polar Surface Area: 64.6?2

2,5-Pyrrolidinedicarboxylic acid, diethyl ester, (2R,5S)-rel- Pricemore >>

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