Base information

Cat. No.
CAS No.1182838-07-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C11H5D9O5
Molecular Weight 235.281
Exact Mass 235.141
XLogP3 1.499
Mr 57.1975
PSA 53.99
Sequence -
Atom number 30
Bond number 30
Ring number 1
Rotor number 5
Residues number 0
Canonical smiles COC(=O)c1cc(OC([2H])([2H])[2H])c(c(c1)OC([2H])([2H])[2H])OC([2H])([2H])[2H]

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