Mixture of Ethanol + 2-Butyl-3-benzofuranyl 4-[(2-diethylamino)ethoxy] 3,5-diiodophenyl ketone, hydrochloride + Water

Excel

Ethanol

Name
Ethanol
InChI
InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
InChI Key
LFQSCWFLJHTTHZ-UHFFFAOYSA-N
Formula
C2H6O
SMILES
CCO
Mol. Weight (g/mol)
46.07
CAS
64-17-5

2-Butyl-3-benzofuranyl 4-[(2-diethylamino)ethoxy] 3,5-diiodophenyl ketone, hydrochloride

Name
2-Butyl-3-benzofuranyl 4-[(2-diethylamino)ethoxy] 3,5-diiodophenyl ketone, hydrochloride
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
InChI Key
ITPDYQOUSLNIHG-UHFFFAOYSA-N
Formula
C25H30ClI2NO3
SMILES
CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCCN(CC)CC)c(I)c1.Cl
Mol. Weight (g/mol)
681.77
CAS
19774-82-4

Water

Name
Water
InChI
InChI=1S/H2O/h1H2
InChI Key
XLYOFNOQVPJJNP-UHFFFAOYSA-N
Formula
H2O
SMILES
O
Mol. Weight (g/mol)
18.02
CAS
7732-18-5
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Datasets

  1. Mole fraction (2)
  2. ρl - Mass density, kg/m3 (2)

Mole fraction of 2-Butyl-3-benzofuranyl 4-[(2-diethylamino)ethoxy] 3,5-diiodophenyl ketone, hydrochloride (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mass fraction of Water (3) - Liquid Mole fraction of 2-Butyl-3-benzofuranyl 4-[(2-diethylamino)ethoxy] 3,5-diiodophenyl ketone, hydrochloride (2) - Liquid
293.20 0.0000 0.0012
293.20 0.1200 0.0023
293.20 0.2400 0.0040
293.20 0.3500 0.0033
293.20 0.4600 0.0026
293.20 0.5600 0.0016
293.20 0.6600 0.0007
293.20 0.7500 0.0003
293.20 0.8400 0.0001
293.20 0.9200 0.0000
293.20 1.0000 4.4000e-06
298.20 0.0000 0.0015
298.20 0.1200 0.0044
298.20 0.2400 0.0055
298.20 0.3500 0.0043
298.20 0.4600 0.0034
298.20 0.5600 0.0021
298.20 0.6600 0.0010
298.20 0.7500 0.0005
298.20 0.8400 0.0001
298.20 0.9200 0.0000
298.20 1.0000 6.3000e-06
303.20 0.0000 0.0023
303.20 0.1200 0.0056
303.20 0.2400 0.0074
303.20 0.3500 0.0062
303.20 0.4600 0.0048
303.20 0.5600 0.0033
303.20 0.6600 0.0016
303.20 0.7500 0.0008
303.20 0.8400 0.0002
303.20 0.9200 0.0000
303.20 1.0000 8.1000e-06
308.20 0.0000 0.0045
308.20 0.1200 0.0085
308.20 0.2400 0.0098
308.20 0.3500 0.0086
308.20 0.4600 0.0064
308.20 0.5600 0.0051
308.20 0.6600 0.0033
308.20 0.7500 0.0015
308.20 0.8400 0.0004
308.20 0.9200 0.0001
308.20 1.0000 9.3000e-06
313.20 0.0000 0.0065
313.20 0.1200 0.0166
313.20 0.2400 0.0167
313.20 0.3500 0.0126
313.20 0.4600 0.0101
313.20 0.5600 0.0077
313.20 0.6600 0.0049
313.20 0.7500 0.0025
313.20 0.8400 0.0008
313.20 0.9200 0.0001
313.20 1.0000 0.0000

Mole fraction of 2-Butyl-3-benzofuranyl 4-[(2-diethylamino)ethoxy] 3,5-diiodophenyl ketone, hydrochloride (2) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mass fraction of Water (3) - Liquid Mole fraction of 2-Butyl-3-benzofuranyl 4-[(2-diethylamino)ethoxy] 3,5-diiodophenyl ketone, hydrochloride (2) - Liquid
293.20 0.0000 0.0012
293.20 0.1200 0.0023
293.20 0.2400 0.0040
293.20 0.3500 0.0033
293.20 0.4600 0.0026
293.20 0.5600 0.0016
293.20 0.6600 0.0007
293.20 0.7500 0.0003
293.20 0.8400 0.0001
293.20 0.9200 0.0000
293.20 1.0000 4.4000e-06
298.20 0.0000 0.0015
298.20 0.1200 0.0044
298.20 0.2400 0.0055
298.20 0.3500 0.0043
298.20 0.4600 0.0034
298.20 0.5600 0.0021
298.20 0.6600 0.0010
298.20 0.7500 0.0005
298.20 0.8400 0.0001
298.20 0.9200 0.0000
298.20 1.0000 6.3000e-06
303.20 0.0000 0.0023
303.20 0.1200 0.0056
303.20 0.2400 0.0074
303.20 0.3500 0.0062
303.20 0.4600 0.0048
303.20 0.5600 0.0033
303.20 0.6600 0.0016
303.20 0.7500 0.0008
303.20 0.8400 0.0002
303.20 0.9200 0.0000
303.20 1.0000 8.1000e-06
308.20 0.0000 0.0045
308.20 0.1200 0.0085
308.20 0.2400 0.0098
308.20 0.3500 0.0086
308.20 0.4600 0.0064
308.20 0.5600 0.0051
308.20 0.6600 0.0033
308.20 0.7500 0.0015
308.20 0.8400 0.0004
308.20 0.9200 0.0001
308.20 1.0000 9.3000e-06
313.20 0.0000 0.0065
313.20 0.1200 0.0166
313.20 0.2400 0.0167
313.20 0.3500 0.0126
313.20 0.4600 0.0101
313.20 0.5600 0.0077
313.20 0.6600 0.0049
313.20 0.7500 0.0025
313.20 0.8400 0.0008
313.20 0.9200 0.0001
313.20 1.0000 0.0000

Mass density, kg/m3 [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mass fraction of Water (3) - Liquid Mass density, kg/m3 - Liquid
293.20 0.0000 820.0
293.20 0.1200 874.0
293.20 0.2400 916.0
293.20 0.3500 944.0
293.20 0.4600 958.0
293.20 0.5600 972.0
293.20 0.6600 984.0
293.20 0.7500 992.0
293.20 0.8400 1010.0
293.20 0.9200 1020.0
293.20 1.0000 1038.0
298.20 0.0000 818.0
298.20 0.1200 872.0
298.20 0.2400 926.0
298.20 0.3500 944.0
298.20 0.4600 964.0
298.20 0.5600 976.0
298.20 0.6600 988.0
298.20 0.7500 1000.0
298.20 0.8400 1004.0
298.20 0.9200 1006.0
298.20 1.0000 1036.0
303.20 0.0000 818.0
303.20 0.1200 880.0
303.20 0.2400 922.0
303.20 0.3500 948.0
303.20 0.4600 964.0
303.20 0.5600 976.0
303.20 0.6600 984.0
303.20 0.7500 990.0
303.20 0.8400 1000.0
303.20 0.9200 1016.0
303.20 1.0000 1030.0
308.20 0.0000 822.0
308.20 0.1200 886.0
308.20 0.2400 938.0
308.20 0.3500 962.0
308.20 0.4600 974.0
308.20 0.5600 988.0
308.20 0.6600 994.0
308.20 0.7500 998.0
308.20 0.8400 1002.0
308.20 0.9200 1018.0
308.20 1.0000 1030.0
313.20 0.0000 818.0
313.20 0.1200 896.0
313.20 0.2400 966.0
313.20 0.3500 1004.0
313.20 0.4600 1020.0
313.20 0.5600 1022.0
313.20 0.6600 1018.0
313.20 0.7500 1012.0
313.20 0.8400 1008.0
313.20 0.9200 1020.0
313.20 1.0000 1028.0

Mass density, kg/m3 [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mass fraction of Water (3) - Liquid Mass density, kg/m3 - Liquid
293.20 0.0000 820.0
293.20 0.1200 874.0
293.20 0.2400 916.0
293.20 0.3500 944.0
293.20 0.4600 958.0
293.20 0.5600 972.0
293.20 0.6600 984.0
293.20 0.7500 992.0
293.20 0.8400 1010.0
293.20 0.9200 1020.0
293.20 1.0000 1038.0
298.20 0.0000 818.0
298.20 0.1200 872.0
298.20 0.2400 926.0
298.20 0.3500 944.0
298.20 0.4600 964.0
298.20 0.5600 976.0
298.20 0.6600 988.0
298.20 0.7500 1000.0
298.20 0.8400 1004.0
298.20 0.9200 1006.0
298.20 1.0000 1036.0
303.20 0.0000 818.0
303.20 0.1200 880.0
303.20 0.2400 922.0
303.20 0.3500 948.0
303.20 0.4600 964.0
303.20 0.5600 976.0
303.20 0.6600 984.0
303.20 0.7500 990.0
303.20 0.8400 1000.0
303.20 0.9200 1016.0
303.20 1.0000 1030.0
308.20 0.0000 822.0
308.20 0.1200 886.0
308.20 0.2400 938.0
308.20 0.3500 962.0
308.20 0.4600 974.0
308.20 0.5600 988.0
308.20 0.6600 994.0
308.20 0.7500 998.0
308.20 0.8400 1002.0
308.20 0.9200 1018.0
308.20 1.0000 1030.0
313.20 0.0000 818.0
313.20 0.1200 896.0
313.20 0.2400 966.0
313.20 0.3500 1004.0
313.20 0.4600 1020.0
313.20 0.5600 1022.0
313.20 0.6600 1018.0
313.20 0.7500 1012.0
313.20 0.8400 1008.0
313.20 0.9200 1020.0
313.20 1.0000 1028.0

Sources