Base information

Cat. No.
CAS No.401797-04-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C13H18BBrO3
Molecular Weight 312.995
Exact Mass 312.053
XLogP3 2.7569
Mr 77.11
PSA 27.69
Sequence -
Atom number 36
Bond number 37
Ring number 2
Rotor number 2
Residues number 0
Canonical smiles COc1cc(Br)cc(c1)B1OC(C(O1)(C)C)(C)C

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