Substance
- Substance Name: 2-methyl-3,5-dinitrobenzoic acid
- Formula: C8H6N2O6
- Molecular Weight: 226.14 g/mol
- Identifiers:
- inchi: InChI=1S/C8H6N2O6/c1-4-6(8(11)12)2-5(9(13)14)3-7(4)10(15)16/h2-3H,1H3,(H,11,12)
- inchikey: CDVNZMKTJIBBBV-UHFFFAOYSA-N
- casrn: 28169-46-2
- csmiles: CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)O
- ismiles: CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)O
- pubchemId: 98824
- iupacname: 2-methyl-3,5-dinitrobenzoic acid
- wikidataId: Q27231494
- chemspiderId: 89258
- dsstoxcmpId: DTXCID6037772
- ecnumber: 248-880-7
2-methyl-3,5-dinitrobenzoic acid
Systems and Datasets
- 2-methyl-3,5-dinitrobenzoic acid (Datasets: 2)
- Dataset 1 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 1, Quantity: Triple point temperature)
- Dataset 2 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 1, Quantity: Molar enthalpy of transition or fusion)
- 2-methyl-3,5-dinitrobenzoic acid + propan-1-ol (Datasets: 1)
- Dataset 3 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 2-methyl-3,5-dinitrobenzoic acid + butan-1-ol (Datasets: 1)
- Dataset 4 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 2-methyl-3,5-dinitrobenzoic acid + pentan-1-ol (Datasets: 1)
- Dataset 5 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 2-methyl-3,5-dinitrobenzoic acid + hexan-1-ol (Datasets: 1)
- Dataset 6 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 2-methyl-3,5-dinitrobenzoic acid + heptan-1-ol (Datasets: 1)
- Dataset 7 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 2-methyl-3,5-dinitrobenzoic acid + propan-2-ol (Datasets: 1)
- Dataset 8 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 2-methyl-3,5-dinitrobenzoic acid + ethyl acetate (Datasets: 1)
- Dataset 9 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 2-methyl-3,5-dinitrobenzoic acid + butan-2-ol (Datasets: 1)
- Dataset 10 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 2-methyl-3,5-dinitrobenzoic acid + cyclohexane (Datasets: 1)
- Dataset 11 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 2-methyl-3,5-dinitrobenzoic acid + toluene (Datasets: 1)
- Dataset 12 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 2-methyl-3,5-dinitrobenzoic acid + ethanol (Datasets: 1)
- Dataset 13 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 2-methyl-3,5-dinitrobenzoic acid + acetonitrile (Datasets: 1)
- Dataset 14 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- 2-methyl-3,5-dinitrobenzoic acid + water (Datasets: 1)
- Dataset 15 in paper 10.1021/acs.jced.9b00497 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)