Mixture of Domperidone + Formamide, N,N-dimethyl- + Water

Domperidone

Name
Domperidone
InChI
InChI=1S/C22H24ClN5O2/c23-15-6-7-20-18(14-15)25-22(30)28(20)16-8-12-26(13-9-16)10-3-11-27-19-5-2-1-4-17(19)24-21(27)29/h1-2,4-7,14,16H,3,8-13H2,(H,24,29)(H,25,30)
InChI Key
FGXWKSZFVQUSTL-UHFFFAOYSA-N
Formula
C22H24ClN5O2
SMILES
O=c1[nH]c2ccccc2n1CCCN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1
Mol. Weight (g/mol)
425.92

Formamide, N,N-dimethyl-

Name
Formamide, N,N-dimethyl-
InChI
InChI=1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3
InChI Key
ZMXDDKWLCZADIW-UHFFFAOYSA-N
Formula
C3H7NO
SMILES
CN(C)C=O
Mol. Weight (g/mol)
73.09
CAS
68-12-2

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
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Datasets

  1. Mole fraction

Mole fraction of Domperidone (1) [ref]

Operational condition: Pressure, kPa = 101.1 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mass fraction of Formamide, N,N-dimethyl- (2) - Liquid Mole fraction of Domperidone (1) - Liquid
293.15 0.0000 1.7480e-07
298.15 0.0000 2.2190e-07
303.15 0.0000 2.7620e-07
308.15 0.0000 3.3520e-07
313.15 0.0000 4.1570e-07
318.15 0.0000 5.1100e-07
323.15 0.0000 6.3840e-07
328.15 0.0000 7.7270e-07
333.15 0.0000 9.3410e-07
293.15 0.1000 1.1430e-06
298.15 0.1000 1.4120e-06
303.15 0.1000 1.7330e-06
308.15 0.1000 2.1140e-06
313.15 0.1000 2.5660e-06
318.15 0.1000 3.0980e-06
323.15 0.1000 3.7210e-06
328.15 0.1000 4.4480e-06
333.15 0.1000 5.2920e-06
293.15 0.2000 4.3240e-06
298.15 0.2000 5.3130e-06
303.15 0.2000 6.4780e-06
308.15 0.2000 7.8410e-06
313.15 0.2000 9.4260e-06
318.15 0.2000 0.0000
323.15 0.2000 0.0000
328.15 0.2000 0.0000
333.15 0.2000 0.0000
293.15 0.3000 0.0000
298.15 0.3000 0.0000
303.15 0.3000 0.0000
308.15 0.3000 0.0000
313.15 0.3000 0.0000
318.15 0.3000 0.0000
323.15 0.3000 0.0000
328.15 0.3000 0.0000
333.15 0.3000 0.0001
293.15 0.4000 0.0000
298.15 0.4000 0.0000
303.15 0.4000 0.0001
308.15 0.4000 0.0001
313.15 0.4000 0.0001
318.15 0.4000 0.0001
323.15 0.4000 0.0001
328.15 0.4000 0.0001
333.15 0.4000 0.0002
293.15 0.5000 0.0001
298.15 0.5000 0.0002
303.15 0.5000 0.0002
308.15 0.5000 0.0002
313.15 0.5000 0.0003
318.15 0.5000 0.0003
323.15 0.5000 0.0004
328.15 0.5000 0.0004
333.15 0.5000 0.0005
293.15 0.6000 0.0004
298.15 0.6000 0.0005
303.15 0.6000 0.0006
308.15 0.6000 0.0008
313.15 0.6000 0.0009
318.15 0.6000 0.0010
323.15 0.6000 0.0012
328.15 0.6000 0.0013
333.15 0.6000 0.0015
293.15 0.7000 0.0012
298.15 0.7000 0.0015
303.15 0.7000 0.0018
308.15 0.7000 0.0021
313.15 0.7000 0.0024
318.15 0.7000 0.0028
323.15 0.7000 0.0032
328.15 0.7000 0.0036
333.15 0.7000 0.0039
293.15 0.8000 0.0022
298.15 0.8000 0.0026
303.15 0.8000 0.0031
308.15 0.8000 0.0035
313.15 0.8000 0.0041
318.15 0.8000 0.0047
323.15 0.8000 0.0054
328.15 0.8000 0.0061
333.15 0.8000 0.0071
293.15 0.9000 0.0010
298.15 0.9000 0.0012
303.15 0.9000 0.0015
308.15 0.9000 0.0018
313.15 0.9000 0.0021
318.15 0.9000 0.0025
323.15 0.9000 0.0028
328.15 0.9000 0.0034
333.15 0.9000 0.0039
293.15 1.0000 0.0002
298.15 1.0000 0.0002
303.15 1.0000 0.0003
308.15 1.0000 0.0004
313.15 1.0000 0.0005
318.15 1.0000 0.0006
323.15 1.0000 0.0007
328.15 1.0000 0.0008
333.15 1.0000 0.0009

Sources