Cas no 141028-29-7 (L-Isoleucine, N-(N-acetyl-L-alanyl)-)

L-Isoleucine, N-(N-acetyl-L-alanyl)- structure
141028-29-7 structure
Product Name:L-Isoleucine, N-(N-acetyl-L-alanyl)-
CAS No:141028-29-7
MF:C11H20N2O4
MW:244.287503242493
CID:1300166
Update Time:2024-08-04

L-Isoleucine, N-(N-acetyl-L-alanyl)- Chemical and Physical Properties

Names and Identifiers

    • L-Isoleucine, N-(N-acetyl-L-alanyl)-
    • L-Isoleucine, N-(N-acetyl-L-alanyl)- (9CI)
    • Inchi: 1S/C11H20N2O4/c1-5-6(2)9(11(16)17)13-10(15)7(3)12-8(4)14/h6-7,9H,5H2,1-4H3,(H,12,14)(H,13,15)(H,16,17)/t6-,7-,9-/m0/s1
    • InChI Key: SIZYZNKQHXRQQQ-ZKWXMUAHSA-N
    • SMILES: C(O)(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](C)NC(C)=O

Computed Properties

  • Exact Mass: 244.1424

Experimental Properties

  • Density: 1.121±0.06 g/cm3(Predicted)
  • Boiling Point: 531.5±35.0 °C(Predicted)
  • PSA: 95.5
  • pka: 3.42±0.10(Predicted)
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