Base information

Cat. No.
CAS No.159755-62-1
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C9H9NO3
Molecular Weight 179.173
Exact Mass 179.058
XLogP3 1.0708
Mr 45.711
PSA 56.26
Sequence -
Atom number 22
Bond number 22
Ring number 1
Rotor number 4
Residues number 0
Canonical smiles CCOC(=O)c1ncccc1C=O

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