Mixture of Water + Cetrimonium Bromide + Phenol, 4,4'-(1-methylethylidene)bis-

Excel

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

Cetrimonium Bromide

Name
Cetrimonium Bromide
InChI
InChI=1S/C19H42N.BrH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;/h5-19H2,1-4H3;1H/q+1;/p-1
InChI Key
LZZYPRNAOMGNLH-UHFFFAOYSA-M
Formula
C19H42BrN
SMILES
Br.CCCCCCCCCCCCCCCC[N+](C)(C)C
Mol. Weight (g/mol)
364.45
CAS
57-09-0

Phenol, 4,4'-(1-methylethylidene)bis-

Name
Phenol, 4,4'-(1-methylethylidene)bis-
InChI
InChI=1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3
InChI Key
IISBACLAFKSPIT-UHFFFAOYSA-N
Formula
C15H16O2
SMILES
CC(C)(c1ccc(O)cc1)c1ccc(O)cc1
Mol. Weight (g/mol)
228.29
CAS
80-05-7
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Datasets

  1. Mass concentration, kg/m3 (2)

Mass concentration, kg/m3 of Phenol, 4,4'-(1-methylethylidene)bis- (3) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Ratio of component mass to volume of solvent, kg/m3 of Cetrimonium Bromide (2) - Liquid Mass concentration, kg/m3 of Phenol, 4,4'-(1-methylethylidene)bis- (3) - Liquid
298.15 0.0000 0.3810
298.15 0.1000 0.4450
298.15 0.2000 0.4310
298.15 0.3000 0.5310
298.15 0.4000 0.5910
298.15 0.8000 0.8780
298.15 1.2 1.182
298.15 2.0 1.526
303.15 0.0000 0.4660
303.15 0.1000 0.4770
303.15 0.2000 0.5640
303.15 0.3000 0.6510
303.15 0.4000 0.7120
303.15 0.8000 1.06
303.15 1.2 1.321
303.15 2.0 1.818
308.15 0.0000 0.5410
308.15 0.1000 0.5720
308.15 0.2000 0.6450
308.15 0.3000 0.7420
308.15 0.4000 0.8040
308.15 0.8000 1.128
308.15 1.2 1.425
308.15 2.0 1.958
313.15 0.0000 0.5940
313.15 0.1000 0.6380
313.15 0.2000 0.7060
313.15 0.3000 0.8210
313.15 0.4000 0.9870
313.15 0.8000 1.295
313.15 1.2 1.591
313.15 2.0 2.261

Mass concentration, kg/m3 of Phenol, 4,4'-(1-methylethylidene)bis- (3) [ref]

Operational condition: Pressure, kPa = 101 (Liquid)

Fixed Measured
Temperature, K - Liquid Solvent: Ratio of component mass to volume of solvent, kg/m3 of Cetrimonium Bromide (2) - Liquid Mass concentration, kg/m3 of Phenol, 4,4'-(1-methylethylidene)bis- (3) - Liquid
298.15 0.0000 0.3810
298.15 0.1000 0.4450
298.15 0.2000 0.4310
298.15 0.3000 0.5310
298.15 0.4000 0.5910
298.15 0.8000 0.8780
298.15 1.2 1.182
298.15 2.0 1.526
303.15 0.0000 0.4660
303.15 0.1000 0.4770
303.15 0.2000 0.5640
303.15 0.3000 0.6510
303.15 0.4000 0.7120
303.15 0.8000 1.06
303.15 1.2 1.321
303.15 2.0 1.818
308.15 0.0000 0.5410
308.15 0.1000 0.5720
308.15 0.2000 0.6450
308.15 0.3000 0.7420
308.15 0.4000 0.8040
308.15 0.8000 1.128
308.15 1.2 1.425
308.15 2.0 1.958
313.15 0.0000 0.5940
313.15 0.1000 0.6380
313.15 0.2000 0.7060
313.15 0.3000 0.8210
313.15 0.4000 0.9870
313.15 0.8000 1.295
313.15 1.2 1.591
313.15 2.0 2.261

Sources