Base information

Cat. No.
CAS No.1186405-17-3
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C13H11ClINO2
Molecular Weight 375.589
Exact Mass 374.952
XLogP3 3.4109
Mr 79.0708
PSA 42.35
Sequence -
Atom number 29
Bond number 30
Ring number 2
Rotor number 4
Residues number 0
Canonical smiles OCc1cc(I)c(c(n1)Cl)OCc1ccccc1

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