Base information

Cat. No.
CAS No.1450-76-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C8H7NO4
Molecular Weight 181.145
Exact Mass 181.038
XLogP3 2.0262
Mr 47.4815
PSA 83.12
Sequence -
Atom number 20
Bond number 20
Ring number 1
Rotor number 2
Residues number 0
Canonical smiles [O-][N+](=O)c1ccc(c(c1)C(=O)C)O

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