Base information

Cat. No.
CAS No.66621-73-6
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C6H6N2O2
Molecular Weight 138.124
Exact Mass 138.043
XLogP3 0.1037
Mr 33.5768
PSA 63.08
Sequence -
Atom number 16
Bond number 16
Ring number 1
Rotor number 2
Residues number 0
Canonical smiles OC(=O)Cc1ncccn1

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