Substance
- Substance Name: 2-butyl-3-benzofuranyl 4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl ketone hydrochloride
- Formula: C25H30ClI2NO3
- Molecular Weight: 681.8 g/mol
- Identifiers:
- inchi: InChI=1S/C25H29I2NO3.ClH/c1-4-7-11-22-23(18-10-8-9-12-21(18)31-22)24(29)17-15-19(26)25(20(27)16-17)30-14-13-28(5-2)6-3;/h8-10,12,15-16H,4-7,11,13-14H2,1-3H3;1H
- inchikey: ITPDYQOUSLNIHG-UHFFFAOYSA-N
- casrn: 19774-82-4
- csmiles: CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)OCC[NH+](CC)CC)I.[Cl-]
- ismiles: CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)OCC[NH+](CC)CC)I.[Cl-]
- pubchemId: 29770
- iupacname: 2-[4-(2-butyl-1-benzofuran-3-carbonyl)-2,6-diiodophenoxy]ethyl-diethylazanium;chloride
- wikidataId: Q27271976
- chemspiderId: 27664
- dsstoxcmpId: DTXCID5017185
- chemblId: CHEMBL1083993
- ecnumber: 243-293-2
2-butyl-3-benzofuranyl 4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl ketone hydrochloride
Systems and Datasets
- ethanol + 2-butyl-3-benzofuranyl 4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl ketone hydrochloride (Datasets: 2)
- Dataset 1 in paper 10.1021/je201268b (Dataseries: 1, Datapoints: 5, Quantity: Mass density)
- Dataset 2 in paper 10.1021/je201268b (Dataseries: 1, Datapoints: 5, Quantity: Mole fraction)
- 2-butyl-3-benzofuranyl 4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl ketone hydrochloride + water (Datasets: 2)
- Dataset 3 in paper 10.1021/je201268b (Dataseries: 1, Datapoints: 5, Quantity: Mass density)
- Dataset 4 in paper 10.1021/je201268b (Dataseries: 1, Datapoints: 7, Quantity: Mole fraction)
- N-methylpyrrolidone + 2-butyl-3-benzofuranyl 4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl ketone hydrochloride (Datasets: 2)
- Dataset 5 in paper 10.1021/je201268b (Dataseries: 1, Datapoints: 5, Quantity: Mass density)
- Dataset 6 in paper 10.1021/je201268b (Dataseries: 1, Datapoints: 5, Quantity: Mole fraction)
- ethanol + 2-butyl-3-benzofuranyl 4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl ketone hydrochloride + water (Datasets: 2)
- Dataset 7 in paper 10.1021/je201268b (Dataseries: 5, Datapoints: 55, Quantity: Mass density)
- Dataset 8 in paper 10.1021/je201268b (Dataseries: 5, Datapoints: 55, Quantity: Mole fraction)
- N-methylpyrrolidone + 2-butyl-3-benzofuranyl 4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl ketone hydrochloride + water (Datasets: 2)
- Dataset 9 in paper 10.1021/je201268b (Dataseries: 5, Datapoints: 55, Quantity: Mass density)
- Dataset 10 in paper 10.1021/je201268b (Dataseries: 5, Datapoints: 55, Quantity: Mole fraction)
- 2-butyl-3-benzofuranyl 4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl ketone hydrochloride + carbon dioxide (Datasets: 1)
- Dataset 1 in paper 10.1016/j.fluid.2017.07.015 (Dataseries: 4, Datapoints: 28, Quantity: Mole fraction)