Cas no 83998-91-8 (Alanine-d4 (9CI))

Alanine-d4 (9CI) structure
Alanine-d4 (9CI) structure
Product Name:Alanine-d4 (9CI)
CAS No:83998-91-8
MF:C3H7NO2
MW:93.1178276538849
CID:720950
PubChem ID:16213419
Update Time:2025-04-19

Alanine-d4 (9CI) Chemical and Physical Properties

Names and Identifiers

    • Alanine-d4 (9CI)
    • DL-ALANINE-2,3,3,3-D4
    • 2-amino-2,3,3,3-tetradeuteriopropanoic acid
    • D98466
    • MS-22724
    • 2-amino(2,3,3,3-(2)H4)propanoic acid
    • alanine-2,3,3,3-d4
    • (2,3,3,3-~2~H_4_)Alanine
    • DL-Alanine(2,3,3,3-D4)
    • (2,3,3,3-(2)H4)alanine
    • alanine-d4
    • 53795-92-9
    • HY-W244382
    • 2-amino(?H?)propanoic acid
    • (+/-)-2-AMINOPROPIONIC ACID-2,3,3,3-D4
    • CS-0370496
    • DL-Alanine-2,3,3,3-d4, 98 atom % D
    • DTXSID30583937
    • CHEBI:143534
    • 83998-91-8
    • 2-aminopropionic acid-2,3,3,3-d4
    • Inchi: 1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/i1D3,2D
    • InChI Key: QNAYBMKLOCPYGJ-MZCSYVLQSA-N
    • SMILES: OC(C([2H])(C([2H])([2H])[2H])N)=O

Computed Properties

  • Exact Mass: 93.072785450g/mol
  • Monoisotopic Mass: 93.072785450g/mol
  • Isotope Atom Count: 4
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 6
  • Rotatable Bond Count: 1
  • Complexity: 61.8
  • 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: -3
  • Topological Polar Surface Area: 63.3?2

Experimental Properties

  • Melting Point: 289?°C (dec.)(lit.)

Alanine-d4 (9CI) Security Information

  • WGK Germany:3
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