Cas no 220858-97-9 (Carbonic acid,mono[2-(dimethylamino)ethyl] ester)

Carbonic acid,mono[2-(dimethylamino)ethyl] ester structure
220858-97-9 structure
Product Name:Carbonic acid,mono[2-(dimethylamino)ethyl] ester
CAS No:220858-97-9
MF:C5H11NO3
MW:133.145741701126
CID:244059
PubChem ID:19419884
Update Time:2025-04-19

Carbonic acid,mono[2-(dimethylamino)ethyl] ester Chemical and Physical Properties

Names and Identifiers

    • Carbonic acid,mono[2-(dimethylamino)ethyl] ester
    • Carbonic acid, mono[2-(dimethylamino)ethyl] ester (9CI)
    • 2-(dimethylamino)ethyl hydrogen carbonate
    • 220858-97-9
    • SCHEMBL303910
    • carbonic acid 2-dimethylamino-ethyl ester
    • DTXSID00598674
    • Inchi: 1S/C5H11NO3/c1-6(2)3-4-9-5(7)8/h3-4H2,1-2H3,(H,7,8)
    • InChI Key: MMHCPNMDOCPQCO-UHFFFAOYSA-N
    • SMILES: O(C(=O)O)CCN(C)C

Computed Properties

  • Exact Mass: 133.07389321g/mol
  • Monoisotopic Mass: 133.07389321g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 4
  • Complexity: 92.2
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -2
  • Topological Polar Surface Area: 49.8?2
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