Mixture of Pentane, 1,5-dichloro- + n-Propyl acetate

Name: Pentane, 1,5-dichloro-
InChI: InChI=1S/C5H10Cl2/c6-4-2-1-3-5-7/h1-5H2
InChI Key: LBKDGROORAKTLC-UHFFFAOYSA-N
Formula: C5H10Cl2
SMILES: ClCCCCCCl
Mol. Weight (g/mol): 141.04
CAS: 628-76-2

Name: n-Propyl acetate
InChI: InChI=1S/C5H10O2/c1-3-4-7-5(2)6/h3-4H2,1-2H3
InChI Key: YKYONYBAUNKHLG-UHFFFAOYSA-N
Formula: C5H10O2
SMILES: CCCOC(C)=O
Mol. Weight (g/mol): 102.13
CAS: 109-60-4

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Datasets

Excess molar enthalpy (molar enthalpy (2)
ρ_l - Mass density, kg/m3 (2)

Excess molar enthalpy (molar enthalpy of mixing), kJ/mol [ref]

Operational conditions:

Pressure, kPa = 101 (Liquid)
Temperature, K = 298.15 (Liquid)

Mole fraction of n-Propyl acetate (2) - Liquid	Excess molar enthalpy (molar enthalpy of mixing), kJ/mol - Liquid
0.0656	-0.0160
0.1426	-0.0200
0.2338	-0.0560
0.3247	-0.1000
0.4088	-0.1410
0.4844	-0.1640
0.5426	-0.1710
0.5428	-0.1720
0.6183	-0.1710
0.6974	-0.1530
0.7844	-0.1180
0.8682	-0.0770
0.9448	-0.0340

Excess molar enthalpy (molar enthalpy of mixing), kJ/mol [ref]

Operational conditions:

Pressure, kPa = 101 (Liquid)
Temperature, K = 298.15 (Liquid)

Mole fraction of n-Propyl acetate (2) - Liquid	Excess molar enthalpy (molar enthalpy of mixing), kJ/mol - Liquid
0.0656	-0.0160
0.1426	-0.0200
0.2338	-0.0560
0.3247	-0.1000
0.4088	-0.1410
0.4844	-0.1640
0.5426	-0.1710
0.5428	-0.1720
0.6183	-0.1710
0.6974	-0.1530
0.7844	-0.1180
0.8682	-0.0770
0.9448	-0.0340

Mass density, kg/m3 [ref]

Operational conditions:

Pressure, kPa = 101 (Liquid)
Temperature, K = 298.15 (Liquid)

Mole fraction of n-Propyl acetate (2) - Liquid	Mass density, kg/m3 - Liquid
0.0592	1083.72
0.1260	1070.79
0.1854	1059.08
0.2502	1046.15
0.3122	1033.6
0.3736	1021.02
0.4950	995.63
0.5537	983.11
0.6672	958.42
0.7269	945.17
0.7802	933.16
0.8365	920.34
0.8890	908.23
0.9471	894.67
1.0000	882.08

Mass density, kg/m3 [ref]

Operational conditions:

Pressure, kPa = 101 (Liquid)
Temperature, K = 298.15 (Liquid)

Mole fraction of n-Propyl acetate (2) - Liquid	Mass density, kg/m3 - Liquid
0.0592	1083.72
0.1260	1070.79
0.1854	1059.08
0.2502	1046.15
0.3122	1033.6
0.3736	1021.02
0.4950	995.63
0.5537	983.11
0.6672	958.42
0.7269	945.17
0.7802	933.16
0.8365	920.34
0.8890	908.23
0.9471	894.67
1.0000	882.08

Sources

Thermodynamic study of (alkyl esters + a,x-alkyl dihalides) VII. HE m and VE m for 20 binary mixtures {xCu 1H2u 1CO2C3H7 + (1 x)a,x-ClCH2(CH2)v 2CH2Cl}, where u = 1 to 4, a = 1 and v = x = 2 to 6. An analysis of behavior using the COSMO-RS methodology