Base information

Cat. No.
CAS No.72159-54-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C10H14N2O6
Molecular Weight 258.228
Exact Mass 258.085
XLogP3 -2.4634
Mr 59.0761
PSA 124.78
Sequence -
Atom number 32
Bond number 33
Ring number 2
Rotor number 2
Residues number 0
Canonical smiles C[C@H]([C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc(=O)[nH]c1=O)O

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