Base information

Cat. No.
CAS No.639084-05-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C13H15IN2O3
Molecular Weight 374.174
Exact Mass 374.013
XLogP3 3.4327
Mr 81.144
PSA 53.35
Sequence -
Atom number 34
Bond number 35
Ring number 2
Rotor number 4
Residues number 0
Canonical smiles COc1cccc2c1n(nc2I)C(=O)OC(C)(C)C

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