Chemical Properties of Hexanedioic acid, dipropyl ester (CAS 106-19-4)

InChI

InChI=1S/C12H22O4/c1-3-9-15-11(13)7-5-6-8-12(14)16-10-4-2/h3-10H2,1-2H3

InChI Key

NKOUWLLFHNBUDW-UHFFFAOYSA-N

Formula

C12H22O4

SMILES

CCCOC(=O)CCCCC(=O)OCCC

Molecular Weight¹

230.30

CAS

106-19-4

Other Names

• Adipic acid di-n-propyl ester
• Di-n-Propyl adipate
• adipic acid, dipropyl ester
• dipropyl adipate
• dipropyl hexanedioate

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• P_vap : Vapor pressure (kPa).
• ρ_l : Liquid Density (kg/m³).
• I_np : Non-polar retention indices.
• D^*_i : Self diffusion coefficient (m²/s).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Contents

1. Physical Properties
2. Temperature Dependent Properties
3. Datasets
4. Similar Compounds
5. Sources

Physical Properties

Property	Value	Unit	Source
ΔfG°	-417.68	kJ/mol	Joback Calculated Property
ΔfH°gas	-780.61	kJ/mol	Joback Calculated Property
ΔfusH°	32.41	kJ/mol	Joback Calculated Property
ΔvapH°	60.62	kJ/mol	Joback Calculated Property
log10WS	-2.57		Crippen Calculated Property
logPoct/wat	2.453		Crippen Calculated Property
McVol	194.820	ml/mol	McGowan Calculated Property
Pc	1927.05	kPa	Joback Calculated Property
Inp	[1540.00; 1588.00]
Inp	1569.00		NIST
Inp	1554.00		NIST
Inp	1545.00		NIST
Inp	1577.00		NIST
Inp	Outlier 1588.00		NIST
Inp	1544.00		NIST
Inp	1545.00		NIST
Inp	1543.00		NIST
Inp	1544.00		NIST
Inp	1569.00		NIST
Inp	1540.00		NIST
Inp	1545.00		NIST
Inp	1569.00		NIST
Inp	1554.00		NIST
Inp	1544.00		NIST
Inp	1545.00		NIST
Tboil	626.54	K	Joback Calculated Property
Tc	803.91	K	Joback Calculated Property
Tfus	369.32	K	Joback Calculated Property
Vc	0.755	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[515.96; 593.78]	J/mol×K	[626.54; 803.91]
T(K) Ideal gas heat capacity (J/mol×K) 520 540 560 580 600 650 700 750 800
Cp,gas	515.96	J/mol×K	626.54	Joback Calculated Property
Cp,gas	530.51	J/mol×K	656.10	Joback Calculated Property
Cp,gas	544.42	J/mol×K	685.66	Joback Calculated Property
Cp,gas	557.71	J/mol×K	715.23	Joback Calculated Property
Cp,gas	570.37	J/mol×K	744.79	Joback Calculated Property
Cp,gas	582.39	J/mol×K	774.35	Joback Calculated Property
Cp,gas	593.78	J/mol×K	803.91	Joback Calculated Property
η	[0.0001522; 0.0017118]	Pa×s	[369.32; 626.54]
T(K) Dynamic viscosity (Pa×s) 0 5.00e-4 1.00e-3 1.50e-3 400 500 600
η	0.0017118	Pa×s	369.32	Joback Calculated Property
η	0.0009273	Pa×s	412.19	Joback Calculated Property
η	0.0005638	Pa×s	455.06	Joback Calculated Property
η	0.0003735	Pa×s	497.93	Joback Calculated Property
η	0.0002641	Pa×s	540.80	Joback Calculated Property
η	0.0001965	Pa×s	583.67	Joback Calculated Property
η	0.0001522	Pa×s	626.54	Joback Calculated Property
ΔvapH	63.60	kJ/mol	476.50	NIST
Pvap	[1.73e-03; 0.06]	kPa	[318.80; 365.30]
T(K) Vapor pressure (kPa) 0 0.01 0.02 0.03 0.04 0.05 0.06 0.07 320 340 360
Pvap	1.73e-03	kPa	318.80	Vapor P...
Pvap	2.22e-03	kPa	321.70	Vapor P...
Pvap	2.60e-03	kPa	323.50	Vapor P...
Pvap	3.67e-03	kPa	327.40	Vapor P...
Pvap	6.02e-03	kPa	333.20	Vapor P...
Pvap	7.65e-03	kPa	336.10	Vapor P...
Pvap	9.72e-03	kPa	339.10	Vapor P...
Pvap	0.01	kPa	342.10	Vapor P...
Pvap	0.02	kPa	345.50	Vapor P...
Pvap	0.02	kPa	348.30	Vapor P...
Pvap	0.03	kPa	351.50	Vapor P...
Pvap	0.03	kPa	354.20	Vapor P...
Pvap	0.04	kPa	357.10	Vapor P...
Pvap	0.05	kPa	361.20	Vapor P...
Pvap	0.06	kPa	365.30	Vapor P...
D*i	[0.00; 0.00]	m2/s	[293.43; 338.47]
T(K) Self diffusion coefficient (m2/s) 2.00e-10 3.00e-10 4.00e-10 5.00e-10 6.00e-10 7.00e-10 300 310 320 330
D*i	0.00	m2/s	293.43	Self-di...
D*i	0.00	m2/s	302.44	Self-di...
D*i	0.00	m2/s	311.45	Self-di...
D*i	0.00	m2/s	320.46	Self-di...
D*i	0.00	m2/s	329.45	Self-di...
D*i	0.00	m2/s	338.47	Self-di...

Datasets

1. Viscosity, Pa*s (2)
2. Mass density, kg/m3 (1)

Viscosity, Pa*s

Fixed		Measured
Temperature, K - Liquid	Pressure, kPa - Liquid	Viscosity, Pa*s - Liquid
283.15	100.00	0.0062
283.15	1000.00	0.0062
283.15	5000.00	0.0065
283.15	10000.00	0.0069
283.15	15000.00	0.0074
283.15	20000.00	0.0078
283.15	30000.00	0.0088
283.15	40000.00	0.0098
293.15	100.00	0.0046
293.14	1000.00	0.0047
293.15	5000.00	0.0049
293.15	10000.00	0.0052
293.15	15000.00	0.0055
293.15	20000.00	0.0058
293.15	30000.00	0.0064
293.15	40000.00	0.0072
303.15	100.00	0.0036
303.15	1000.00	0.0036
303.15	5000.00	0.0038
303.15	10000.00	0.0040
303.15	15000.00	0.0042
303.15	20000.00	0.0044
303.15	30000.00	0.0049
303.15	40000.00	0.0055
313.15	100.00	0.0029
313.15	1000.00	0.0029
313.15	5000.00	0.0030
313.15	10000.00	0.0032
313.15	15000.00	0.0033
313.15	20000.00	0.0035
313.15	30000.00	0.0039
313.15	40000.00	0.0043
323.15	100.00	0.0023
323.15	1000.00	0.0024
323.15	5000.00	0.0025
323.14	10000.00	0.0026
323.15	15000.00	0.0027
323.15	20000.00	0.0029
323.15	30000.00	0.0032
323.15	40000.00	0.0035
333.15	100.00	0.0020
333.15	1000.00	0.0020
333.15	5000.00	0.0021
333.15	10000.00	0.0022
333.15	15000.00	0.0023
333.15	20000.00	0.0024
333.15	30000.00	0.0026
333.15	40000.00	0.0029
343.15	100.00	0.0017
343.15	1000.00	0.0017
343.15	5000.00	0.0017
343.15	10000.00	0.0018
343.15	15000.00	0.0019
343.15	20000.00	0.0020
343.15	30000.00	0.0022
343.15	40000.00	0.0024
353.15	100.00	0.0014
353.15	1000.00	0.0014
353.15	5000.00	0.0015
353.15	10000.00	0.0016
353.15	15000.00	0.0017
353.15	20000.00	0.0017
353.15	30000.00	0.0019
353.15	40000.00	0.0021
363.15	100.00	0.0012
363.15	1000.00	0.0013
363.15	5000.00	0.0013
363.15	10000.00	0.0014
363.15	15000.00	0.0014
363.15	20000.00	0.0015
363.15	30000.00	0.0016
363.15	40000.00	0.0018
Reference

Fixed		Measured
Temperature, K - Liquid	Pressure, kPa - Liquid	Viscosity, Pa*s - Liquid
303.14	1140.00	0.0036
303.14	1110.00	0.0036
303.14	1110.00	0.0036
303.15	2810.00	0.0037
303.15	2820.00	0.0037
303.15	2810.00	0.0037
303.14	5220.00	0.0038
303.14	5220.00	0.0038
303.14	5210.00	0.0038
303.15	10310.00	0.0040
303.15	10320.00	0.0040
303.15	10310.00	0.0040
303.15	15310.00	0.0042
303.15	15260.00	0.0042
303.15	15230.00	0.0042
303.14	18290.00	0.0043
303.14	18290.00	0.0043
303.14	18280.00	0.0043
313.16	1200.00	0.0029
313.16	1220.00	0.0029
313.16	1210.00	0.0029
313.15	2710.00	0.0029
313.16	2700.00	0.0029
313.15	2710.00	0.0029
313.16	5190.00	0.0030
313.16	5180.00	0.0030
313.16	5180.00	0.0030
313.16	10490.00	0.0032
313.16	10480.00	0.0032
313.16	10460.00	0.0032
313.15	15330.00	0.0034
313.15	15330.00	0.0034
313.15	15330.00	0.0034
313.16	18290.00	0.0034
313.15	18290.00	0.0034
313.15	18290.00	0.0034
323.15	1180.00	0.0024
323.15	1170.00	0.0024
323.15	1160.00	0.0024
323.16	2720.00	0.0024
323.16	2710.00	0.0024
323.16	2710.00	0.0024
323.16	5270.00	0.0025
323.16	5270.00	0.0025
323.16	5260.00	0.0025
323.17	10210.00	0.0026
323.17	10220.00	0.0026
323.17	10220.00	0.0026
323.16	15200.00	0.0027
323.16	15200.00	0.0027
323.15	15180.00	0.0027
323.17	18270.00	0.0028
323.17	18240.00	0.0028
323.17	18260.00	0.0028
333.16	1090.00	0.0020
333.16	1120.00	0.0020
333.16	1100.00	0.0020
333.14	2620.00	0.0020
333.14	2610.00	0.0020
333.15	2620.00	0.0020
333.15	5130.00	0.0021
333.15	5110.00	0.0021
333.15	5110.00	0.0021
333.16	10190.00	0.0022
333.16	10180.00	0.0022
333.16	10160.00	0.0022
333.16	15220.00	0.0023
333.15	15220.00	0.0023
333.15	15200.00	0.0023
333.15	18300.00	0.0023
333.15	18290.00	0.0023
333.15	18260.00	0.0023
Reference

Mass density, kg/m3

Fixed		Measured
Temperature, K - Liquid	Pressure, kPa - Liquid	Mass density, kg/m3 - Liquid
293.15	100.00	979.3
293.15	520.00	979.7
293.15	1040.00	980.0
293.15	2530.00	981.0
293.15	5020.00	982.5
293.15	7510.00	984.1
293.15	7530.00	984.2
293.15	10010.00	985.7
293.15	15050.00	988.9
293.15	20010.00	991.8
293.15	30030.00	997.7
293.15	39800.00	1003.1
293.15	50070.00	1008.4
293.15	65000.00	1015.7
303.15	100.00	970.3
303.15	100.00	970.4
303.15	500.00	970.7
303.15	1010.00	971.1
303.15	2510.00	972.1
303.15	2510.00	972.1
303.15	5000.00	973.8
303.15	7510.00	975.5
303.15	10020.00	977.1
303.15	15010.00	980.4
303.15	20000.00	983.5
303.15	30010.00	989.6
303.15	39800.00	995.2
303.15	50010.00	1000.7
303.15	64990.00	1008.3
313.15	100.00	961.5
313.15	500.00	961.8
313.15	1010.00	962.2
313.15	2510.00	963.3
313.15	5040.00	965.1
313.15	7510.00	966.8
313.15	10010.00	968.5
313.15	15000.00	971.9
313.15	19980.00	975.2
313.15	30000.00	981.6
313.15	39810.00	987.4
313.15	39800.00	987.4
313.15	50060.00	993.2
313.15	65000.00	1001.0
323.15	100.00	952.4
323.15	500.00	952.8
323.15	1010.00	953.2
323.15	2530.00	954.3
323.15	5020.00	956.2
323.15	7510.00	958.0
323.15	7550.00	958.1
323.15	10000.00	959.9
323.15	15030.00	963.4
323.15	20010.00	966.9
323.15	30010.00	973.5
323.15	39820.00	979.5
323.15	50020.00	985.5
323.15	64990.00	993.7
333.15	100.00	943.5
333.15	500.00	943.9
333.15	1020.00	944.3
333.15	2520.00	945.5
333.15	5010.00	947.5
333.15	7510.00	949.4
333.15	7510.00	949.4
333.15	10000.00	951.3
333.15	15000.00	955.1
333.15	20000.00	958.7
333.15	30020.00	965.6
333.15	39790.00	971.9
333.15	50050.00	978.1
333.15	65000.00	986.5
343.15	100.00	934.6
343.15	520.00	935.0
343.15	1040.00	935.5
343.15	2540.00	936.7
343.15	5020.00	938.8
343.15	7520.00	940.8
343.15	7510.00	940.8
343.15	10020.00	942.8
343.15	15000.00	946.7
343.15	20030.00	950.6
343.15	29580.00	957.4
343.15	39860.00	964.3
343.15	50020.00	970.7
343.15	65000.00	979.4
353.15	100.00	925.7
353.15	510.00	926.1
353.15	1020.00	926.5
353.15	2530.00	927.9
353.15	5020.00	930.1
353.15	7510.00	932.2
353.15	7530.00	932.2
353.15	10000.00	934.3
353.15	14550.00	938.0
353.15	20020.00	942.3
353.15	30010.00	949.8
353.15	39800.00	956.7
353.15	49990.00	963.4
353.15	64990.00	972.4
363.15	100.00	916.7
363.15	500.00	917.2
363.15	980.00	917.6
363.15	2520.00	919.1
363.15	5000.00	921.3
363.15	7480.00	923.6
363.15	7480.00	923.6
363.15	10020.00	925.8
363.15	15020.00	930.1
363.15	20020.00	934.2
363.15	30020.00	942.0
363.15	39810.00	949.1
363.15	50050.00	956.1
363.15	64970.00	965.4
303.15	100.00	970.4
303.15	510.00	970.7
303.15	5030.00	973.8
303.15	10010.00	977.1
303.15	30000.00	989.6
303.15	65010.00	1008.3
Reference

Similar Compounds

Find more compounds similar to Hexanedioic acid, dipropyl ester.

Sources

• Crippen Method
• Crippen Method
• Viscosity Measurements of Dialkyl Adipates in the Temperature Range of (283 to 363) K and up to 40 MPa
• Density measurements of compressed dipropyl, dibutyl, bis(2-ethylhexyl) adipates from (293 to 373 K) at pressures up to about 68 MPa
• Viscosity measurements of compressed liquid dipropyl and dibutyl adipates
• Self-diffusivity measurements of dimethyl, diethyl, dipropyl, dibutyl, Bis(2-ethylhexyl) adipates from (293 - 339) K by a PGSE-NMR spin-echo technique
• Vapor Pressures and Enthalpies of Vaporization of a Series of the Symmetric Linear n-Alkyl Esters of Dicarboxylic Acids
• Joback Method
• McGowan Method
• NIST Webbook

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