Cas no 153620-64-5 (L-Proline,1-(3,4-dihydro-2H-pyrrol-5-yl)-)

L-Proline,1-(3,4-dihydro-2H-pyrrol-5-yl)- structure
153620-64-5 structure
Product Name:L-Proline,1-(3,4-dihydro-2H-pyrrol-5-yl)-
CAS No:153620-64-5
MF:C9H14N2O2
MW:182.219662189484
CID:98855
PubChem ID:45116164
Update Time:2025-04-18

L-Proline,1-(3,4-dihydro-2H-pyrrol-5-yl)- Chemical and Physical Properties

Names and Identifiers

    • L-Proline,1-(3,4-dihydro-2H-pyrrol-5-yl)-
    • L-Proline, 1-(3,4-dihydro-2H-pyrrol-5-yl)- (9CI)
    • (S)-1-(3,4-Dihydro-2H-pyrrol-5-yl)pyrrolidine-2-carboxylic acid
    • 153620-64-5
    • Inchi: 1S/C9H14N2O2/c12-9(13)7-3-2-6-11(7)8-4-1-5-10-8/h7H,1-6H2,(H,12,13)/t7-/m0/s1
    • InChI Key: STSCOBKDNGEFAZ-ZETCQYMHSA-N
    • SMILES: OC([C@@H]1CCCN1C1CCCN=1)=O

Computed Properties

  • Exact Mass: 182.10562
  • Monoisotopic Mass: 182.105527694g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 250
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.2
  • Topological Polar Surface Area: 52.9?2

Experimental Properties

  • PSA: 52.9
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