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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 19082421Generated: October 24, 2026

3-tert-Butylamino-4-(3,4-dichlorobenzylamino)-cyclobut-3-ene-1,2-dione

https://huagongshe.com/en/chemical/19082421

3-tert-Butylamino-4-(3,4-dichlorobenzylamino)-cyclobut-3-ene-1,2-dione molecular structure

Identifiers & Physical Properties

Molecular formulaC15H16Cl2N2O2
Average molar mass327.2 g/mol
Monoisotopic mass326.0588831 g/mol
SMILESCC(C)(C)Nc1c(NCc2ccc(Cl)c(Cl)c2)c(=O)c1=O
InChIKeyKJVGAENQETUOFH-UHFFFAOYSA-N
PubChem CID19082421

Chemical & Physical Properties

XLogP3.7
Topological polar surface area58.2
Hydrogen bond donors2
Hydrogen bond acceptors4
Rotatable bonds5
Heavy atoms21
Formal charge0
Complexity483