Base information

Cat. No.
CAS No.2597-56-0
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C8H7NO5
Molecular Weight 197.145
Exact Mass 197.032
XLogP3 1.8248
Mr 48.7153
PSA 92.35
Sequence -
Atom number 21
Bond number 21
Ring number 1
Rotor number 3
Residues number 0
Canonical smiles COc1cc(ccc1C(=O)O)[N+](=O)[O-]

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