Base information

Cat. No.
CAS No.67643-67-8
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C12H11NO3
Molecular Weight 217.221
Exact Mass 217.074
XLogP3 1.3806
Mr 61.753
PSA 46.61
Sequence -
Atom number 27
Bond number 28
Ring number 2
Rotor number 4
Residues number 0
Canonical smiles C=COCCN1C(=O)c2c(C1=O)cccc2

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