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The combustion energies were measured using high\u2010precision combustion calorimetry, and the enthalpies of formation of the crystal phase were derived. The sublimation enthalpies were obtained from the vapor pressure\u2010temperature dependencies measured using the classic Knudsen effusion mass loss and the transpiration methods. The standard molar enthalpies of vaporisation were derived from the temperature dependence of the mass\u2010loss rates measured using the non\u2010isothermal thermogravimetry. The thermal behaviour, including melting temperatures and standard molar enthalpies of fusion, was investigated by DSC. The high\u2010level quantum chemical G* methods were used for the mutual validation of the experimental and theoretical gas phase enthalpies of formation of methyl\u2010substituted nitrobenzoic acids. The consistent set of experimental properties at the reference temperature\n                    <jats:italic>T<\/jats:italic>\n                    =298\u2009K was evaluated and recommended for thermochemical calculations. The pairwise interactions of the substituents on the benzene ring were derived from nitro\u2010toluenes, methyl\u2010benzoic acids and nitro\u2010benzoic acids available in the literature, and the additivity of the contributions when three substituents are placed simultaneously in the benzene ring was discussed.\n                  <\/jats:p>","DOI":"10.1002\/cplu.202400703","type":"journal-article","created":{"date-parts":[[2025,2,3]],"date-time":"2025-02-03T07:56:11Z","timestamp":1738569371000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":2,"title":["Thermodynamic Insights on the Structure\u2010Property Relationships in Substituted Benzenes: Are the Pairwise Interactions in Tri\u2010Substituted Methyl\u2010Nitro\u2010Benzoic Acids Still Valid?"],"prefix":"10.1002","volume":"90","author":[{"ORCID":"https:\/\/orcid.org\/0000-0003-1360-5327","authenticated-orcid":false,"given":"Jos\u00e9 M.","family":"Silva Ferraz","sequence":"first","affiliation":[{"name":"Department of Basic and Applied Sciences for Engineering (S.B.A.I.) 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