Substance
- Substance Name: 2-methyl-3-nitrobenzoic acid
- Formula: C8H7NO4
- Molecular Weight: 181.15 g/mol
- Identifiers:
- inchi: InChI=1S/C8H7NO4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3,(H,10,11)
- inchikey: YPQAFWHSMWWPLX-UHFFFAOYSA-N
- casrn: 1975-50-4
- csmiles: CC1=C(C=CC=C1[N+](=O)[O-])C(=O)O
- ismiles: CC1=C(C=CC=C1[N+](=O)[O-])C(=O)O
- pubchemId: 16096
- iupacname: 2-methyl-3-nitrobenzoic acid
- wikidataId: Q27237202
- chemspiderId: 15284
- dsstoxcmpId: DTXCID405637
- chemblId: CHEMBL1487536
- ecnumber: 217-826-4
2-methyl-3-nitrobenzoic acid
Systems and Datasets
- methanol + 2-methyl-3-nitrobenzoic acid (Datasets: 1)
- Dataset 1 in paper 10.1016/j.jct.2017.02.017 (Dataseries: 1, Datapoints: 15, Quantity: Mole fraction)
- ethanol + 2-methyl-3-nitrobenzoic acid (Datasets: 1)
- Dataset 2 in paper 10.1016/j.jct.2017.02.017 (Dataseries: 1, Datapoints: 15, Quantity: Mole fraction)
- propan-1-ol + 2-methyl-3-nitrobenzoic acid (Datasets: 1)
- Dataset 3 in paper 10.1016/j.jct.2017.02.017 (Dataseries: 1, Datapoints: 15, Quantity: Mole fraction)
- propan-2-ol + 2-methyl-3-nitrobenzoic acid (Datasets: 1)
- Dataset 4 in paper 10.1016/j.jct.2017.02.017 (Dataseries: 1, Datapoints: 15, Quantity: Mole fraction)
- acetonitrile + 2-methyl-3-nitrobenzoic acid (Datasets: 1)
- Dataset 5 in paper 10.1016/j.jct.2017.02.017 (Dataseries: 1, Datapoints: 15, Quantity: Mole fraction)
- ethyl acetate + 2-methyl-3-nitrobenzoic acid (Datasets: 1)
- Dataset 6 in paper 10.1016/j.jct.2017.02.017 (Dataseries: 1, Datapoints: 15, Quantity: Mole fraction)
- acetone + 2-methyl-3-nitrobenzoic acid (Datasets: 1)
- Dataset 7 in paper 10.1016/j.jct.2017.02.017 (Dataseries: 1, Datapoints: 15, Quantity: Mole fraction)
- 1,4-dioxane + 2-methyl-3-nitrobenzoic acid (Datasets: 1)
- Dataset 8 in paper 10.1016/j.jct.2017.02.017 (Dataseries: 1, Datapoints: 14, Quantity: Mole fraction)
- butanone + 2-methyl-3-nitrobenzoic acid (Datasets: 1)
- Dataset 9 in paper 10.1016/j.jct.2017.02.017 (Dataseries: 1, Datapoints: 15, Quantity: Mole fraction)