Base information

Cat. No.
CAS No.1073353-75-9
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C12H17BBrNO3
Molecular Weight 313.983
Exact Mass 313.048
XLogP3 2.1519
Mr 74.905
PSA 40.58
Sequence -
Atom number 35
Bond number 36
Ring number 2
Rotor number 2
Residues number 0
Canonical smiles COc1ncc(cc1B1OC(C(O1)(C)C)(C)C)Br

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