Cas no 137506-06-0 (L-Aspartic acid, N-[N-(N-L-alanyl-L-alanyl)-L-alanyl]-)

L-Aspartic acid, N-[N-(N-L-alanyl-L-alanyl)-L-alanyl]- structure
137506-06-0 structure
Product Name:L-Aspartic acid, N-[N-(N-L-alanyl-L-alanyl)-L-alanyl]-
CAS No:137506-06-0
MF:C13H22N4O7
MW:346.336383342743
CID:1245252
Update Time:2024-08-03

L-Aspartic acid, N-[N-(N-L-alanyl-L-alanyl)-L-alanyl]- Chemical and Physical Properties

Names and Identifiers

    • L-Aspartic acid, N-[N-(N-L-alanyl-L-alanyl)-L-alanyl]-
    • L-Aspartic acid, N-[N-(N-L-alanyl-L-alanyl)-L-alanyl]- (9CI)
    • Inchi: 1S/C13H22N4O7/c1-5(14)10(20)15-6(2)11(21)16-7(3)12(22)17-8(13(23)24)4-9(18)19/h5-8H,4,14H2,1-3H3,(H,15,20)(H,16,21)(H,17,22)(H,18,19)(H,23,24)/t5-,6-,7-,8-/m0/s1
    • InChI Key: PUXHZYMUYAGVOA-XAMCCFCMSA-N
    • SMILES: C(O)(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C)N

Computed Properties

  • Exact Mass: 346.14896

Experimental Properties

  • Density: 1.356±0.06 g/cm3(Predicted)
  • Boiling Point: 739.2±60.0 °C(Predicted)
  • PSA: 187.92
  • pka: 2.88±0.10(Predicted)
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