Base information

Cat. No.
CAS No.77-55-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C12H14O2
Molecular Weight 190.238
Exact Mass 190.099
XLogP3 2.583
Mr 54.9838
PSA 37.3
Sequence -
Atom number 28
Bond number 29
Ring number 2
Rotor number 2
Residues number 0
Canonical smiles OC(=O)C1(CCCC1)c1ccccc1

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