Base information

Cat. No.
CAS No.1219806-03-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C10H6D4O4
Molecular Weight 198.209
Exact Mass 198.083
XLogP3 1.5615
Mr 49.4878
PSA 63.6
Sequence -
Atom number 24
Bond number 24
Ring number 1
Rotor number 4
Residues number 0
Canonical smiles CCOC(=O)c1c([2H])c([2H])c(c(c1C(=O)O)[2H])[2H]

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