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The molecular formula is C15H13N5O4.
Some synonyms include Ethyl 2-Nitro-4,5-di(1H-pyrazol-1-yl)benzoate and ethyl 2-nitro-4,5-di(pyrazol-1-yl)benzoate.
The molecular weight is 327.29 g/mol.
The IUPAC name is ethyl 2-nitro-4,5-di(pyrazol-1-yl)benzoate.
The InChI is InChI=1S/C15H13N5O4/c1-2-24-15(21)11-9-13(18-7-3-5-16-18)14(10-12(11)20(22)23)19-8-4-6-17-19/h3-10H,2H2,1H3.
The InChIKey is VGSVCOTZKCUFSO-UHFFFAOYSA-N.
The canonical SMILES is CCOC(=O)C1=CC(=C(C=C1[N+](=O)[O-])N2C=CC=N2)N3C=CC=N3.
The XLogP3-AA value is 1.9.
Ethyl 2-nitro-4,5-di(1-pyrazolyl)benzoate has 0 hydrogen bond donor counts.
Ethyl 2-nitro-4,5-di(1-pyrazolyl)benzoate has 6 hydrogen bond acceptor counts.
1256633-17-6
1256633-38-1
1256633-33-6
1256633-39-2
1256633-26-7
1272756-05-4
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