Base information

Cat. No.
CAS No.1199586-87-2
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C13H13BrO4
Molecular Weight 313.144
Exact Mass 312
XLogP3 2.3084
Mr 67.5848
PSA 55.76
Sequence -
Atom number 31
Bond number 33
Ring number 3
Rotor number 2
Residues number 0
Canonical smiles OC(=O)C1(CC2(C1)OCCO2)c1ccc(cc1)Br

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