Base information

Cat. No.
CAS No.135484-78-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C8H8BrNO2
Molecular Weight 230.059
Exact Mass 228.974
XLogP3 2.3991
Mr 49.8259
PSA 52.32
Sequence -
Atom number 20
Bond number 20
Ring number 1
Rotor number 2
Residues number 0
Canonical smiles COC(=O)c1c(N)cccc1Br

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