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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 178953255Generated: November 1, 2026

4-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid

STK268622 · EU-0045051 · AK-918/11940226 · 4-(1,3-Dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid · 4-(3,5-Dioxo-4-aza-tricyclo[5.2.1.0(2,6)]dec-4-yl) benzoic acid · Benzoic acid, 4-(octahydro-1,3-dioxo-4,7-methano-2H-isoindol-2-yl)-

https://huagongshe.com/en/chemical/178953255

4-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)benzoic acid molecular structure

Identifiers & Physical Properties

CAS No.354158-53-5
Molecular formulaC16H15NO4
Average molar mass285.29 g/mol
SMILESO=C(O)c1ccc(N2C(=O)C3C4CCC(C4)C3C2=O)cc1
InChIKeyOYRRYCDONHLKGG-UHFFFAOYSA-N

Chemical & Physical Properties

XLogP2
Topological polar surface area74.7
Hydrogen bond donors1
Hydrogen bond acceptors4
Rotatable bonds2
Heavy atoms21
Formal charge0
Complexity480
Boiling point593.5±33.0 °C(Predicted)
Density1.424±0.06 g/cm3(Predicted)
pKa (acidity coefficient)4.33±0.10(Predicted)