Substance
- Substance Name: 2-[[3-(trifluoromethyl)phenyl]amino]benzoic acid
- Formula: C14H10F3NO2
- Molecular Weight: 281.23 g/mol
- Identifiers:
- inchi: InChI=1S/C14H10F3NO2/c15-14(16,17)9-4-3-5-10(8-9)18-12-7-2-1-6-11(12)13(19)20/h1-8,18H,(H,19,20)
- inchikey: LPEPZBJOKDYZAD-UHFFFAOYSA-N
- casrn: 530-78-9
- csmiles: C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC(=C2)C(F)(F)F
- ismiles: C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC(=C2)C(F)(F)F
- pubchemId: 3371
- iupacname: 2-[3-(trifluoromethyl)anilino]benzoic acid
- wikidataId: Q416341
- chemspiderId: 3254
- dsstoxcmpId: DTXCID303063
- chemblId: CHEMBL23588
- ecnumber: 208-494-1
2-[[3-(trifluoromethyl)phenyl]amino]benzoic acid
Systems and Datasets
- 2-[[3-(trifluoromethyl)phenyl]amino]benzoic acid (Datasets: 2)
- Dataset 1 in paper 10.1021/acs.jced.9b00278 (Dataseries: 1, Datapoints: 1, Quantity: Triple point temperature)
- Dataset 2 in paper 10.1021/acs.jced.9b00278 (Dataseries: 1, Datapoints: 1, Quantity: Triple point temperature)
- 2-[[3-(trifluoromethyl)phenyl]amino]benzoic acid + acetonitrile + water (Datasets: 2)
- Dataset 3 in paper 10.1021/acs.jced.9b00278 (Dataseries: 3, Datapoints: 29, Quantity: Mole fraction)
- Dataset 4 in paper 10.1021/acs.jced.9b00278 (Dataseries: 4, Datapoints: 40, Quantity: Mole fraction)
- 2-[[3-(trifluoromethyl)phenyl]amino]benzoic acid + propan-2-ol + water (Datasets: 1)
- Dataset 5 in paper 10.1021/acs.jced.9b00278 (Dataseries: 3, Datapoints: 27, Quantity: Mole fraction)
- 2-[[3-(trifluoromethyl)phenyl]amino]benzoic acid + acetonitrile (Datasets: 2)
- Dataset 6 in paper 10.1021/acs.jced.9b00278 (Dataseries: 1, Datapoints: 3, Quantity: Mole fraction)
- Dataset 7 in paper 10.1021/acs.jced.9b00278 (Dataseries: 1, Datapoints: 4, Quantity: Mole fraction)
- 2-[[3-(trifluoromethyl)phenyl]amino]benzoic acid + water (Datasets: 1)
- Dataset 8 in paper 10.1021/acs.jced.9b00278 (Dataseries: 1, Datapoints: 1, Quantity: Mole fraction)
- 2-[[3-(trifluoromethyl)phenyl]amino]benzoic acid + propan-2-ol (Datasets: 1)
- Dataset 9 in paper 10.1021/acs.jced.9b00278 (Dataseries: 1, Datapoints: 3, Quantity: Mole fraction)