Base information

Cat. No.
CAS No.118158-53-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C12H17N3O2
Molecular Weight 235.282
Exact Mass 235.132
XLogP3 2.18
Mr 75.6787
PSA 61.09
Sequence -
Atom number 34
Bond number 35
Ring number 2
Rotor number 3
Residues number 0
Canonical smiles [O-][N+](=O)c1ccc(cc1)CN1CCNCCC1

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