Mixture of Isopropyl Alcohol + Histidine + Water

Excel

Isopropyl Alcohol

Name
Isopropyl Alcohol
InChI
InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3
InChI Key
KFZMGEQAYNKOFK-UHFFFAOYSA-N
Formula
C3H8O
SMILES
CC(C)O
Mol. Weight (g/mol)
60.09
CAS
67-63-0

Histidine

Name
Histidine
InChI
InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m1/s1
InChI Key
HNDVDQJCIGZPNO-RXMQYKEDSA-N
Formula
C6H9N3O2
SMILES
NC(Cc1c[nH]cn1)C(=O)O
Mol. Weight (g/mol)
155.15
CAS
71-00-1

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 (2)

Mole fraction of Histidine (2) [ref]

Operational condition: Pressure, kPa = 100 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mole fraction of Isopropyl Alcohol (1) - Liquid Mole fraction of Histidine (2) - Liquid
283.15 0.0000 0.0035
283.15 0.0500 0.0018
283.15 0.1000 0.0011
283.15 0.2000 0.0006
283.15 0.3000 0.0003
283.15 0.4000 0.0002
283.15 0.5000 0.0001
283.15 0.6000 0.0000
288.15 0.0000 0.0038
288.15 0.0500 0.0021
288.15 0.1000 0.0013
288.15 0.2000 0.0007
288.15 0.3000 0.0004
288.15 0.4000 0.0002
288.15 0.5000 0.0001
288.15 0.6000 0.0000
293.15 0.0000 0.0042
293.15 0.0500 0.0024
293.15 0.1000 0.0016
293.15 0.2000 0.0009
293.15 0.3000 0.0005
293.15 0.4000 0.0002
293.15 0.5000 0.0001
293.15 0.6000 0.0000
298.15 0.0000 0.0046
298.15 0.0500 0.0029
298.15 0.1000 0.0020
298.15 0.2000 0.0011
298.15 0.3000 0.0006
298.15 0.4000 0.0003
298.15 0.5000 0.0001
298.15 0.6000 0.0000
303.15 0.0000 0.0051
303.15 0.0500 0.0033
303.15 0.1000 0.0023
303.15 0.2000 0.0013
303.15 0.3000 0.0007
303.15 0.4000 0.0004
303.15 0.5000 0.0002
303.15 0.6000 0.0001
308.15 0.0000 0.0056
308.15 0.0500 0.0038
308.15 0.1000 0.0028
308.15 0.2000 0.0015
308.15 0.3000 0.0008
308.15 0.4000 0.0004
308.15 0.5000 0.0002
308.15 0.6000 0.0001
313.15 0.0000 0.0061
313.15 0.0500 0.0043
313.15 0.1000 0.0032
313.15 0.2000 0.0018
313.15 0.3000 0.0010
313.15 0.4000 0.0005
313.15 0.5000 0.0003
313.15 0.6000 0.0001
318.15 0.0000 0.0067
318.15 0.0500 0.0050
318.15 0.1000 0.0038
318.15 0.2000 0.0021
318.15 0.3000 0.0012
318.15 0.4000 0.0006
318.15 0.5000 0.0003
318.15 0.6000 0.0001

Mole fraction of Histidine (2) [ref]

Operational condition: Pressure, kPa = 100 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mole fraction of Isopropyl Alcohol (1) - Liquid Mole fraction of Histidine (2) - Liquid
283.15 0.0000 0.0035
283.15 0.0500 0.0018
283.15 0.1000 0.0011
283.15 0.2000 0.0006
283.15 0.3000 0.0003
283.15 0.4000 0.0002
283.15 0.5000 0.0001
283.15 0.6000 0.0000
288.15 0.0000 0.0038
288.15 0.0500 0.0021
288.15 0.1000 0.0013
288.15 0.2000 0.0007
288.15 0.3000 0.0004
288.15 0.4000 0.0002
288.15 0.5000 0.0001
288.15 0.6000 0.0000
293.15 0.0000 0.0042
293.15 0.0500 0.0024
293.15 0.1000 0.0016
293.15 0.2000 0.0009
293.15 0.3000 0.0005
293.15 0.4000 0.0002
293.15 0.5000 0.0001
293.15 0.6000 0.0000
298.15 0.0000 0.0046
298.15 0.0500 0.0029
298.15 0.1000 0.0020
298.15 0.2000 0.0011
298.15 0.3000 0.0006
298.15 0.4000 0.0003
298.15 0.5000 0.0001
298.15 0.6000 0.0000
303.15 0.0000 0.0051
303.15 0.0500 0.0033
303.15 0.1000 0.0023
303.15 0.2000 0.0013
303.15 0.3000 0.0007
303.15 0.4000 0.0004
303.15 0.5000 0.0002
303.15 0.6000 0.0001
308.15 0.0000 0.0056
308.15 0.0500 0.0038
308.15 0.1000 0.0028
308.15 0.2000 0.0015
308.15 0.3000 0.0008
308.15 0.4000 0.0004
308.15 0.5000 0.0002
308.15 0.6000 0.0001
313.15 0.0000 0.0061
313.15 0.0500 0.0043
313.15 0.1000 0.0032
313.15 0.2000 0.0018
313.15 0.3000 0.0010
313.15 0.4000 0.0005
313.15 0.5000 0.0003
313.15 0.6000 0.0001
318.15 0.0000 0.0067
318.15 0.0500 0.0050
318.15 0.1000 0.0038
318.15 0.2000 0.0021
318.15 0.3000 0.0012
318.15 0.4000 0.0006
318.15 0.5000 0.0003
318.15 0.6000 0.0001

Sources