Mixture of Propanoic acid, propyl ester + Pentane, 1,5-dichloro-

Name: Propanoic acid, propyl ester
InChI: InChI=1S/C6H12O2/c1-3-5-8-6(7)4-2/h3-5H2,1-2H3
InChI Key: MCSINKKTEDDPNK-UHFFFAOYSA-N
Formula: C6H12O2
SMILES: CCCOC(=O)CC
Mol. Weight (g/mol): 116.16
CAS: 106-36-5

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

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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 Propanoic acid, propyl ester (1) - Liquid	Excess molar enthalpy (molar enthalpy of mixing), kJ/mol - Liquid
0.0588	-0.0170
0.1375	-0.0570
0.2257	-0.1010
0.3118	-0.1570
0.3922	-0.2070
0.4517	-0.2410
0.4693	-0.2470
0.5239	-0.2550
0.5982	-0.2460
0.6783	-0.2200
0.7663	-0.1780
0.8550	-0.1200
0.9359	-0.0610

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

Operational conditions:

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

Mole fraction of Propanoic acid, propyl ester (1) - Liquid	Excess molar enthalpy (molar enthalpy of mixing), kJ/mol - Liquid
0.0588	-0.0170
0.1375	-0.0570
0.2257	-0.1010
0.3118	-0.1570
0.3922	-0.2070
0.4517	-0.2410
0.4693	-0.2470
0.5239	-0.2550
0.5982	-0.2460
0.6783	-0.2200
0.7663	-0.1780
0.8550	-0.1200
0.9359	-0.0610

Mass density, kg/m3 [ref]

Operational conditions:

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

Mole fraction of Propanoic acid, propyl ester (1) - Liquid	Mass density, kg/m3 - Liquid
0.0586	1081.99
0.1204	1068.2
0.1736	1056.39
0.2854	1031.55
0.3403	1019.42
0.4006	1006.12
0.5242	978.97
0.6350	954.74
0.6961	941.43
0.7548	928.67
0.8219	914.07
0.8809	901.3
0.9420	888.12
1.0000	875.61

Mass density, kg/m3 [ref]

Operational conditions:

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

Mole fraction of Propanoic acid, propyl ester (1) - Liquid	Mass density, kg/m3 - Liquid
0.0586	1081.99
0.1204	1068.2
0.1736	1056.39
0.2854	1031.55
0.3403	1019.42
0.4006	1006.12
0.5242	978.97
0.6350	954.74
0.6961	941.43
0.7548	928.67
0.8219	914.07
0.8809	901.3
0.9420	888.12
1.0000	875.61

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