Cas no 21291-44-1 (5-[(5-Oxidanidyl-5-oxidanylidene-L-norvalyl)oxy]dodecane)

5-[(5-Oxidanidyl-5-oxidanylidene-L-norvalyl)oxy]dodecane structure
21291-44-1 structure
Product Name:5-[(5-Oxidanidyl-5-oxidanylidene-L-norvalyl)oxy]dodecane
CAS No:21291-44-1
MF:C17H32NO4
MW:314.440285682678
CID:2842662
Update Time:2023-08-07

5-[(5-Oxidanidyl-5-oxidanylidene-L-norvalyl)oxy]dodecane Chemical and Physical Properties

Names and Identifiers

    • 5-[(5-Oxidanidyl-5-oxidanylidene-L-norvalyl)oxy]dodecane
    • Inchi: 1S/C17H33NO4/c1-3-5-7-8-9-11-14(10-6-4-2)22-17(21)15(18)12-13-16(19)20/h14-15H,3-13,18H2,1-2H3,(H,19,20)/p-1/t14?,15-/m0/s1
    • InChI Key: JUEQYKZCQFWFPL-LOACHALJSA-M
    • SMILES: O(C([C@H](CCC(=O)[O-])N)=O)C(CCCC)CCCCCCC

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 14
  • Complexity: 302
  • XLogP3: 2.7
  • Topological Polar Surface Area: 92.4
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