Cas no 887587-20-4 (tert-Butyl 3-(Propylamino)pyrrolidine-1-carboxylate)

tert-Butyl 3-(Propylamino)pyrrolidine-1-carboxylate structure
887587-20-4 structure
Product Name:tert-Butyl 3-(Propylamino)pyrrolidine-1-carboxylate
CAS No:887587-20-4
MF:C12H24N2O2
MW:228.331163406372
MDL:MFCD06656603
CID:713437
PubChem ID:50987929
Update Time:2025-04-19

tert-Butyl 3-(Propylamino)pyrrolidine-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • 1-Pyrrolidinecarboxylicacid, 3-(propylamino)-, 1,1-dimethylethyl ester
    • 3-PROPYLAMINO-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
    • tert-butyl 3-(propylamino)pyrrolidine-1-carboxylate
    • EN300-69919
    • AB3511
    • Z1069359970
    • DTXSID70679065
    • 887587-20-4
    • MFCD06656603
    • AKOS017333363
    • tert-butyl3-(propylamino)pyrrolidine-1-carboxylate
    • tert-Butyl 3-(Propylamino)pyrrolidine-1-carboxylate
    • MDL: MFCD06656603
    • Inchi: 1S/C12H24N2O2/c1-5-7-13-10-6-8-14(9-10)11(15)16-12(2,3)4/h10,13H,5-9H2,1-4H3
    • InChI Key: VUTULUPDGBEPBY-UHFFFAOYSA-N
    • SMILES: O(C(C)(C)C)C(N1CCC(C1)NCCC)=O

Computed Properties

  • Exact Mass: 228.184
  • Monoisotopic Mass: 228.184
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 6
  • Complexity: 236
  • 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
  • Topological Polar Surface Area: 41.6A^2
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 1.8

Experimental Properties

  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 304.3±35.0 °C at 760 mmHg
  • Flash Point: 137.8±25.9 °C
  • Vapor Pressure: 0.0±0.6 mmHg at 25°C

tert-Butyl 3-(Propylamino)pyrrolidine-1-carboxylate Security Information

tert-Butyl 3-(Propylamino)pyrrolidine-1-carboxylate Pricemore >>

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