Base information

Cat. No.
CAS No.523977-64-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C8H4BrNO
Molecular Weight 210.027
Exact Mass 208.948
XLogP3 2.13328
Mr 44.2445
PSA 40.86
Sequence -
Atom number 15
Bond number 15
Ring number 1
Rotor number 1
Residues number 0
Canonical smiles N#Cc1cc(Br)ccc1C=O

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