Cas no 72057-18-2 (Methyl pyrrolidine-3-carboxylate)

Methyl pyrrolidine-3-carboxylate structure
72057-18-2 structure
Product Name:Methyl pyrrolidine-3-carboxylate
CAS No:72057-18-2
MF:C6H11NO2
MW:129.157041788101
CID:1005800
PubChem ID:4114360
Update Time:2025-04-20

Methyl pyrrolidine-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl pyrrolidine-3-carboxylate
    • Methyl 3-pyrrolidinecarboxylate
    • 3-methoxycarbonylpyrrolidine
    • Pyrrolidine-3-carboxylic acid methyl ester
    • 72057-18-2
    • AC-24325
    • 3-carbomethoxypyrrolidine
    • SY122122
    • methyl (+/-)-3-pyrrolidinecarboxylate
    • SCHEMBL584094
    • PB24144
    • J-502259
    • VVWWZOKQKXPVIV-UHFFFAOYSA-N
    • 3-Pyrrolidinecarboxylic acid, methyl ester
    • PB20842
    • 98548-90-4
    • SB10233
    • Methylpyrrolidine-3-carboxylate
    • NCGC00322849-01
    • EN300-41575
    • AKOS000181489
    • FT-0648801
    • AB01319048-02
    • MFCD03788461
    • BS-13042
    • A25983
    • AM20120399
    • SY009240
    • methyl (R)-pyrrolidine-3-carboxylate
    • PB24127
    • DTXSID60399462
    • FT-0687381
    • BCP26307
    • FT-0647928
    • MFCD13191636
    • DB-070360
    • DB-000295
    • DB-361009
    • DB-066582
    • Inchi： 1S/C6H11NO2/c1-9-6(8)5-2-3-7-4-5/h5,7H,2-4H2,1H3
    • InChI Key： VVWWZOKQKXPVIV-UHFFFAOYSA-N
    • SMILES： O(C)C(C1CNCC1)=O

Computed Properties

  • Exact Mass: 129.078978594g/mol
  • Monoisotopic Mass: 129.078978594g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 2
  • Complexity: 114
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.2
  • Topological Polar Surface Area: 38.3?2

Methyl pyrrolidine-3-carboxylate Related Literature

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