Base information

Cat. No.
CAS No.3663-21-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C12H16N2O3
Molecular Weight 236.267
Exact Mass 236.116
XLogP3 3.492
Mr 68.9637
PSA 74.92
Sequence -
Atom number 33
Bond number 33
Ring number 1
Rotor number 6
Residues number 0
Canonical smiles CCCCc1ccc(c(c1)[N+](=O)[O-])NC(=O)C

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