2
0
2010
son
li
0
journal
Original
Song, L.[Liangcheng]
Li, M.[Minxu]
Gong, J.[Junbo]
J. Chem. Eng. Data
2010
2020-09-29
Solubility of Clopidogrel Hydrogen Sulfate (Form II) in Different Solvents
As an urgent need in the design and upscale of the industrial crystallization process, solubilities of clopidogrel hydrogen sulfate (Form II) in ethanol, propanol, isopropanol, butanol, and acetone were measured using a laser-monitoring technique at temperatures ranging from (278.15 to 318.15) K. The experimental data were fitted well by the modified Apelblat equation.
10.1021/je100022w
9
55
4016-4018
1
InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
LFQSCWFLJHTTHZ-UHFFFAOYSA-N
ethanol
ethyl alcohol
C2H6O
1
Commercial source
1
99.5
3
Estimated by the compiler
2
InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3
BDERNNFJNOPAEC-UHFFFAOYSA-N
propan-1-ol
1-propanol
n-propanol
n-propyl alcohol
C3H8O
1
Commercial source
1
99.5
3
Estimated by the compiler
3
InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3
KFZMGEQAYNKOFK-UHFFFAOYSA-N
propan-2-ol
2-propanol
isopropanol
isopropyl alcohol
sec-propyl alcohol
C3H8O
1
Commercial source
1
99.5
3
Estimated by the compiler
4
InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3
LRHPLDYGYMQRHN-UHFFFAOYSA-N
butan-1-ol
1-butanol
n-butanol
n-butyl alcohol
C4H10O
1
Commercial source
1
99.5
3
Estimated by the compiler
5
InChI=1S/C3H6O/c1-3(2)4/h1-2H3
CSCPPACGZOOCGX-UHFFFAOYSA-N
acetone
2-propanone
dimethyl ketone
propan-2-one
propanone
pyroacetic ether
C3H6O
1
Commercial source
1
99.5
3
Estimated by the compiler
6
InChI=1S/C16H16ClNO2S.H2O4S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14;1-5(2,3)4/h2-5,7,9,15H,6,8,10H2,1H3;(H2,1,2,3,4)/t15-;/m0./s1
FDEODCTUSIWGLK-RSAXXLAASA-N
(S)-(+)-Clopidogrel hydrogen sulfate
(+)-(S)-5-[(2-Chlorophenyl)(methoxycarbonyl)methyl]-4,5,6,7-tetrahydrothieno[3,2-c]-pyridin-5-ium hydrogen sulfate]
C16H18ClNO6S2
1
Commercial source
1
Fractional crystallization
2
99
2
HPLC
1
6
1
Principal objective of the work
AB
TRC
4/17/2019
1
Triple point temperature, K
DSC
Crystal 2
Direct value, X
1
Data file compiler
Propagation of evaluated standard uncertainties
95
Crystal 2
Liquid
Gas
1
449.15
4
1
1
2
1
1
6
1
Principal objective of the work
AB
TRC
4/17/2019
1
Mole fraction
Titration method
6
Liquid
Direct value, X
1
Data file compiler
Propagation of evaluated standard uncertainties
95
Liquid
Crystal 2
6
1
Pressure, kPa
Liquid
101.325
6
1
Temperature, K
Liquid
1
278.15
5
1
0.006242
4
1
0.000624
1
283.15
5
1
0.006985
4
1
0.000699
1
288.15
5
1
0.007961
4
1
0.000796
1
293.15
5
1
0.009169
4
1
0.000917
1
298.15
5
1
0.01067
4
1
0.00107
1
303.15
5
1
0.01244
4
1
0.00124
1
308.15
5
1
0.01479
4
1
0.00148
1
313.25
5
1
0.01799
4
1
0.0018
1
318.15
5
1
0.02156
4
1
0.00216
3
2
1
6
1
Principal objective of the work
AB
TRC
4/17/2019
1
Mole fraction
Titration method
6
Liquid
Direct value, X
1
Data file compiler
Propagation of evaluated standard uncertainties
95
Liquid
Crystal 2
6
1
Pressure, kPa
Liquid
101.325
6
1
Temperature, K
Liquid
1
278.15
5
1
0.001436
4
1
0.000144
1
283.15
5
1
0.00198
4
1
0.000198
1
288.15
5
1
0.002584
4
1
0.000258
1
293.15
5
1
0.003179
4
1
0.000318
1
298.15
5
1
0.003743
4
1
0.000374
1
303.15
5
1
0.004295
4
1
0.00043
1
308.15
5
1
0.005232
4
1
0.000523
1
313.15
5
1
0.006356
4
1
0.000636
1
318.15
5
1
0.008223
4
1
0.000822
4
3
1
6
1
Principal objective of the work
AB
TRC
4/17/2019
1
Mole fraction
Titration method
6
Liquid
Direct value, X
1
Data file compiler
Propagation of evaluated standard uncertainties
95
Liquid
Crystal 2
6
1
Pressure, kPa
Liquid
101.325
6
1
Temperature, K
Liquid
1
278.15
5
1
4.263e-05
4
1
4.26e-06
1
283.2
4
1
7.724e-05
4
1
7.73e-06
1
288.12
5
1
0.0001459
4
1
1.46e-05
1
293.2
4
1
0.0002746
4
1
2.75e-05
1
298.21
5
1
0.0004919
4
1
4.92e-05
1
303.17
5
1
0.0007505
4
1
7.51e-05
1
308.2
4
1
0.001052
4
1
0.000105
1
313.15
5
1
0.001399
4
1
0.00014
1
318.15
5
1
0.001843
4
1
0.000184
5
4
1
6
1
Principal objective of the work
AB
TRC
4/17/2019
1
Mole fraction
Titration method
6
Liquid
Direct value, X
1
Data file compiler
Propagation of evaluated standard uncertainties
95
Liquid
Crystal 2
6
1
Pressure, kPa
Liquid
101.325
6
1
Temperature, K
Liquid
1
278.15
5
1
0.0005912
4
1
5.91e-05
1
283.15
5
1
0.0007346
4
1
7.35e-05
1
288.15
5
1
0.0009752
4
1
9.75e-05
1
293.15
5
1
0.001238
4
1
0.000124
1
298.15
5
1
0.001635
4
1
0.000164
1
303.15
5
1
0.002126
4
1
0.000213
1
308.15
5
1
0.002698
4
1
0.00027
1
313.15
5
1
0.003343
4
1
0.000334
1
318.15
5
1
0.00426
4
1
0.000426
6
5
1
6
1
Principal objective of the work
AB
TRC
4/17/2019
1
Mole fraction
Titration method
6
Liquid
Direct value, X
1
Data file compiler
Propagation of evaluated standard uncertainties
95
Liquid
Crystal 2
6
1
Pressure, kPa
Liquid
101.325
6
1
Temperature, K
Liquid
1
278.1
4
1
0.0003802
4
1
3.8e-05
1
283.15
5
1
0.0004355
4
1
4.36e-05
1
288.24
5
1
0.0005032
4
1
5.03e-05
1
293.13
5
1
0.0005903
4
1
5.9e-05
1
298.23
5
1
0.0006925
4
1
6.93e-05
1
303.29
5
1
0.0008278
4
1
8.28e-05
1
308.36
5
1
0.0009687
4
1
9.69e-05
1
313.23
5
1
0.001126
4
1
0.000113
1
318.05
5
1
0.001334
4
1
0.000133