Base information

Cat. No.
CAS No.87102-64-5
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C13H13N3O2
Molecular Weight 243.261
Exact Mass 243.101
XLogP3 2.34256
Mr 66.0368
PSA 79.21
Sequence -
Atom number 31
Bond number 32
Ring number 2
Rotor number 5
Residues number 0
Canonical smiles [N-]=[N+]=NCC(COc1cccc2c1cccc2)O

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