Base information

Cat. No.
CAS No.848779-86-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C9H12BBrO3
Molecular Weight 258.905
Exact Mass 258.006
XLogP3 0.9177
Mr 60.0736
PSA 49.69
Sequence -
Atom number 26
Bond number 26
Ring number 1
Rotor number 4
Residues number 0
Canonical smiles CCCOc1c(Br)cccc1B(O)O

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