Substance
- Substance Name: 3-nitrobenzoic acid
- Formula: C7H5NO4
- Molecular Weight: 167.12 g/mol
- Identifiers:
- casrn: 121-92-6
- pubchemId: 8497
- inchi: InChI=1S/C7H5NO4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)
- inchikey: AFPHTEQTJZKQAQ-UHFFFAOYSA-N
- csmiles: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)O
- ismiles: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)O
- iupacname: 3-nitrobenzoic acid
- wikidataId: Q4634183
- chemspiderId: 8183
- dsstoxcmpId: DTXCID605737
- chemblId: CHEMBL274839
- ecnumber: 204-508-5
3-nitrobenzoic acid
Systems and Datasets
- 3-nitrobenzoic acid (Datasets: 2)
- Dataset 2 in paper 10.1021/je800080w (Dataseries: 1, Datapoints: 1, Quantity: Normal melting temperature)
- Dataset 6 in paper 10.1016/j.jct.2018.05.003 (Dataseries: 1, Datapoints: 1, Quantity: Normal melting temperature)
- ethanol + 3-nitrobenzoic acid + 2-nitrobenzoic acid (Datasets: 2)
- Dataset 3 in paper 10.1021/je800080w (Dataseries: 3, Datapoints: 18, Quantity: Mass fraction)
- Dataset 4 in paper 10.1021/je800080w (Dataseries: 3, Datapoints: 24, Quantity: Mass fraction)
- 4-nitrobenzoic acid + ethanol + 3-nitrobenzoic acid (Datasets: 2)
- Dataset 1 in paper 10.1021/je900364y (Dataseries: 3, Datapoints: 35, Quantity: Mass fraction)
- Dataset 2 in paper 10.1021/je900364y (Dataseries: 3, Datapoints: 13, Quantity: Mass fraction)
- 3-nitrobenzoic acid + carbon dioxide (Datasets: 1)
- Dataset 3 in paper 10.1016/j.tca.2011.01.039 (Dataseries: 3, Datapoints: 15, Quantity: Mole fraction)
- 3,5-dinitrobenzoic acid + 3-nitrobenzoic acid + carbon dioxide (Datasets: 2)
- Dataset 4 in paper 10.1016/j.tca.2011.01.039 (Dataseries: 3, Datapoints: 15, Quantity: Mole fraction)
- Dataset 5 in paper 10.1016/j.tca.2011.01.039 (Dataseries: 3, Datapoints: 15, Quantity: Mole fraction)
- 3-nitrobenzoic acid + water (Datasets: 2)
- Dataset 6 in paper 10.1016/j.fluid.2006.10.014 (Dataseries: 1, Datapoints: 16, Quantity: Solid-liquid equilibrium temperature)
- Dataset 2 in paper 10.1016/j.jct.2007.12.006 (Dataseries: 1, Datapoints: 14, Quantity: Molality)
- 4-nitrobenzoic acid + acetone + 3-nitrobenzoic acid (Datasets: 4)
- Dataset 1 in paper 10.1016/j.fluid.2009.07.011 (Dataseries: 2, Datapoints: 9, Quantity: Mass density)
- Dataset 2 in paper 10.1016/j.fluid.2009.07.011 (Dataseries: 2, Datapoints: 20, Quantity: Mass density)
- Dataset 3 in paper 10.1016/j.fluid.2009.07.011 (Dataseries: 2, Datapoints: 20, Quantity: Mass fraction)
- Dataset 4 in paper 10.1016/j.fluid.2009.07.011 (Dataseries: 2, Datapoints: 9, Quantity: Mass fraction)
- 3-aminobenzoic acid + 3-nitrobenzoic acid + carbon dioxide (Datasets: 1)
- Dataset 2 in paper 10.1016/j.fluid.2013.01.021 (Dataseries: 3, Datapoints: 15, Quantity: Mole fraction)
- acetone + 3,5-dinitrobenzoic acid + 3-nitrobenzoic acid (Datasets: 4)
- Dataset 2 in paper 10.1016/j.jct.2016.10.004 (Dataseries: 3, Datapoints: 18, Quantity: Mass fraction)
- Dataset 3 in paper 10.1016/j.jct.2016.10.004 (Dataseries: 3, Datapoints: 15, Quantity: Mass fraction)
- Dataset 4 in paper 10.1016/j.jct.2016.10.004 (Dataseries: 1, Datapoints: 3, Quantity: Mass fraction)
- Dataset 5 in paper 10.1016/j.jct.2016.10.004 (Dataseries: 1, Datapoints: 3, Quantity: Mass fraction)
- pentyl ethanoate + 3-nitrobenzoic acid (Datasets: 1)
- Dataset 48 in paper 10.1016/j.jct.2018.05.003 (Dataseries: 1, Datapoints: 1, Quantity: Mole fraction)