Mixture of Isopropyl Alcohol + Water + Pentaerythritol tetrakis[3-(3',5'-di-tert-butyl-4'-hydroxyphenyl)propionate]

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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

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

Pentaerythritol tetrakis[3-(3',5'-di-tert-butyl-4'-hydroxyphenyl)propionate]

Name
Pentaerythritol tetrakis[3-(3',5'-di-tert-butyl-4'-hydroxyphenyl)propionate]
InChI
InChI=1S/C73H108O12/c1-65(2,3)49-33-45(34-50(61(49)78)66(4,5)6)25-29-57(74)82-41-73(42-83-58(75)30-26-46-35-51(67(7,8)9)62(79)52(36-46)68(10,11)12,43-84-59(76)31-27-47-37-53(69(13,14)15)63(80)54(38-47)70(16,17)18)44-85-60(77)32-28-48-39-55(71(19,20)21)64(81)56(40-48)72(22,23)24/h33-40,78-81H,25-32,41-44H2,1-24H3
InChI Key
BGYHLZZASRKEJE-UHFFFAOYSA-N
Formula
C73H108O12
SMILES
CC(C)(C)c1cc(CCC(=O)OCC(COC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)(COC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)COC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O
Mol. Weight (g/mol)
1177.63
CAS
6683-19-8
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Datasets

  1. Mass fraction (2)

Mass fraction of Pentaerythritol tetrakis[3-(3',5'-di-tert-butyl-4'-hydroxyphenyl)propionate] (3) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mass fraction of Water (2) - Liquid Mass fraction of Pentaerythritol tetrakis[3-(3',5'-di-tert-butyl-4'-hydroxyphenyl)propionate] (3) - Liquid
293.15 0.0000 0.0001
293.15 0.0300 0.0001
293.15 0.0500 0.0001
298.15 0.0000 0.0002
298.15 0.0300 0.0002
298.15 0.0500 0.0001
303.15 0.0000 0.0004
303.15 0.0300 0.0003
303.15 0.0500 0.0002
308.15 0.0000 0.0006
308.15 0.0300 0.0005
308.15 0.0500 0.0003
313.15 0.0000 0.0010
313.15 0.0300 0.0008
313.15 0.0500 0.0005
318.15 0.0000 0.0016
318.15 0.0300 0.0012
318.15 0.0500 0.0008
323.15 0.0000 0.0025
323.15 0.0300 0.0022
323.15 0.0500 0.0012
328.15 0.0000 0.0041
328.15 0.0300 0.0032
328.15 0.0500 0.0022
333.15 0.0000 0.0064
333.15 0.0300 0.0049
333.15 0.0500 0.0029

Mass fraction of Pentaerythritol tetrakis[3-(3',5'-di-tert-butyl-4'-hydroxyphenyl)propionate] (3) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Mass fraction of Water (2) - Liquid Mass fraction of Pentaerythritol tetrakis[3-(3',5'-di-tert-butyl-4'-hydroxyphenyl)propionate] (3) - Liquid
293.15 0.0000 0.0001
293.15 0.0300 0.0001
293.15 0.0500 0.0001
298.15 0.0000 0.0002
298.15 0.0300 0.0002
298.15 0.0500 0.0001
303.15 0.0000 0.0004
303.15 0.0300 0.0003
303.15 0.0500 0.0002
308.15 0.0000 0.0006
308.15 0.0300 0.0005
308.15 0.0500 0.0003
313.15 0.0000 0.0010
313.15 0.0300 0.0008
313.15 0.0500 0.0005
318.15 0.0000 0.0016
318.15 0.0300 0.0012
318.15 0.0500 0.0008
323.15 0.0000 0.0025
323.15 0.0300 0.0022
323.15 0.0500 0.0012
328.15 0.0000 0.0041
328.15 0.0300 0.0032
328.15 0.0500 0.0022
333.15 0.0000 0.0064
333.15 0.0300 0.0049
333.15 0.0500 0.0029

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