Cas no 65414-78-0 (D-Aspartic Acid 1-Methyl Ester)

D-Aspartic Acid 1-Methyl Ester structure
65414-78-0 structure
Product Name:D-Aspartic Acid 1-Methyl Ester
CAS No:65414-78-0
MF:C5H9NO4
MW:147.129261732101
MDL:MFCD03424227
CID:95360
PubChem ID:7020023
Update Time:2025-04-18

D-Aspartic Acid 1-Methyl Ester Chemical and Physical Properties

Names and Identifiers

    • (R)-3-Amino-4-methoxy-4-oxobutanoic acid
    • H-D-Asp-Ome
    • (3R)-3-amino-4-methoxy-4-oxobutanoic acid
    • D-Aspartic Acid 1-Methyl Ester
    • D-Asp-Ome
    • (3R)-3-azaniumyl-4-methoxy-4-oxobutanoate
    • DS-6569
    • 65414-78-0
    • CS-0128336
    • D-Aspartic acid,1-methyl ester
    • DTXSID10427209
    • EN300-6734874
    • MFCD03424227
    • AKOS006278624
    • SCHEMBL6259101
    • D-Aspartic acid alpha-methyl ester
    • D-Aspartic acid methyl ester
    • MDL: MFCD03424227
    • Inchi: 1S/C5H9NO4/c1-10-5(9)3(6)2-4(7)8/h3H,2,6H2,1H3,(H,7,8)/t3-/m1/s1
    • InChI Key: SWWBMHIMADRNIK-GSVOUGTGSA-N
    • SMILES: O(C)C([C@@H](CC(=O)O)N)=O

Computed Properties

  • Exact Mass: 147.05300
  • Monoisotopic Mass: 147.05315777g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 4
  • Complexity: 145
  • 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: -3.5
  • Topological Polar Surface Area: 89.6?2

Experimental Properties

  • Density: 1.299
  • Boiling Point: 272.7°C at 760 mmHg
  • Flash Point: 272.7 °C at 760 mmHg
  • Refractive Index: 1.477
  • PSA: 89.62000
  • LogP: -0.33830

D-Aspartic Acid 1-Methyl Ester Security Information

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