Base information

Cat. No.
CAS No.7442-52-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C12H12O3
Molecular Weight 204.222
Exact Mass 204.079
XLogP3 1.6047
Mr 55.1945
PSA 43.37
Sequence -
Atom number 27
Bond number 28
Ring number 2
Rotor number 2
Residues number 0
Canonical smiles COC(=O)C1CCc2c(C1=O)cccc2

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