Base information

Cat. No.
CAS No.139756-01-7
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C8H12N4O3
Molecular Weight 212.206
Exact Mass 212.091
XLogP3 1.6032
Mr 54.9859
PSA 106.73
Sequence -
Atom number 27
Bond number 27
Ring number 1
Rotor number 4
Residues number 0
Canonical smiles CCCc1nn(c(c1[N+](=O)[O-])C(=O)N)C

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