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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 12377873Generated: October 25, 2026

1-(2-Benzoyl-4-nitrophenyl)-3,5-pyrazole dicarboxylic acid dimethyl ester

https://huagongshe.com/en/chemical/12377873

1-(2-Benzoyl-4-nitrophenyl)-3,5-pyrazole dicarboxylic acid dimethyl ester molecular structure

Identifiers & Physical Properties

Molecular formulaC20H15N3O7
Average molar mass409.3 g/mol
Monoisotopic mass409.09099983 g/mol
SMILESCOC(=O)c1cc(C(=O)OC)n(-c2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)n1
InChIKeyKHRBYRBLOKFGMK-UHFFFAOYSA-N
PubChem CID12377873

Chemical & Physical Properties

XLogP3.4
Topological polar surface area133
Hydrogen bond donors0
Hydrogen bond acceptors8
Rotatable bonds7
Heavy atoms30
Formal charge0
Complexity674