Base information

Cat. No.
CAS No.186593-28-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C7H6BrNO2
Molecular Weight 216.032
Exact Mass 214.958
XLogP3 1.7694
Mr 43.436
PSA 39.19
Sequence -
Atom number 17
Bond number 17
Ring number 1
Rotor number 2
Residues number 0
Canonical smiles CC(=O)Oc1ccc(nc1)Br

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