Base information

Cat. No.
CAS No.163130-29-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C26H28ClNO2
Molecular Weight 421.959
Exact Mass 421.181
XLogP3 6.2485
Mr 127.885
PSA 38.66
Sequence -
Atom number 58
Bond number 60
Ring number 3
Rotor number 9
Residues number 0
Canonical smiles ClCC/C(=C(\c1ccccc1)/c1ccc(cc1)OCC[N+](C)(C)[O-])/c1ccccc1

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