Chemical Properties of Naphthalene, decahydro- (CAS 91-17-8)

InChI

InChI=1S/C10H18/c1-2-6-10-8-4-3-7-9(10)5-1/h9-10H,1-8H2

InChI Key

NNBZCPXTIHJBJL-UHFFFAOYSA-N

Formula

C10H18

SMILES

C1CCC2CCCCC2C1

Molecular Weight¹

138.25

CAS

91-17-8

Other Names

• Cis-decahydronaphthalene
• Dec
• Decalin <Isomer not specified>
• Decanhydronaphthalene
• Dekalin
• Dekalina
• NSC 406139
• Naphthalane
• Naphthan
• Naphthane
• UN 1147
• bicyclo[4.4.0]decane
• decahydronaphthalene
• decalin
• decaline
• perhydronaphthalene

• ω : Acentric Factor.
• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid phase heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• 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).
• ρ_l : Liquid Density (kg/m³).
• I_np : Non-polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• S°_liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
• 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.

Physical Properties

Property	Value	Unit	Source
ω	0.4155		PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
ΔcH°liquid	-6226.52	kJ/mol	NIST
ΔfH°gas	-140.33	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	9.53	kJ/mol	Joback Calculated Property
ΔvapH°	50.16	kJ/mol	Relay (1.0) Calculated Property
IE	[9.14; 9.35]	eV
IE	9.14	eV	NIST
IE	9.35	eV	NIST
log10WS	-5.19		Estimated Solubility
logPoct/wat	3.367		Crippen Calculated Property
McVol	130.040	ml/mol	McGowan Calculated Property
Pc	[2010.00; 2080.00]	kPa
Pc	2010.00	kPa	PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
Pc	2080.00 ± 151.99	kPa	NIST
Inp	[173.01; 1089.00]
Inp	1042.00		NIST
Inp	1054.00		NIST
Inp	1066.00		NIST
Inp	1063.00		NIST
Inp	1056.00		NIST
Inp	1089.00		NIST
Inp	1055.00		NIST
Inp	1054.00		NIST
Inp	1087.00		NIST
Inp	1064.00		NIST
Inp	1043.00		NIST
Inp	Outlier 173.01		NIST
Inp	Outlier 173.31		NIST
Inp	1089.00		NIST
Inp	1055.00		NIST
Inp	Outlier 173.01		NIST
S°liquid	265.01	J/mol×K	NIST
Tboil	[445.00; 465.00]	K
Tboil	464.25	K	Excess volumes, densities, speeds of sound and viscosities for the binary systems of diisopropyl ether with hydrocarbons at 303.15K
Tboil	463.20	K	NIST
Tboil	465.00 ± 5.00	K	NIST
Tboil	465.00 ± 2.00	K	NIST
Tboil	Outlier 445.00 ± 10.00	K	NIST
Tboil	461.00 ± 6.00	K	NIST
Tc	[645.00; 645.15]	K
Tc	645.15	K	PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
Tc	645.00 ± 2.00	K	NIST
Tfus	149.00 ± 2.50	K	NIST
Vc	0.485	m3/kmol	PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,liquid	[219.00; 284.80]	J/mol×K	[298.00; 420.00]
Cp,liquid	233.51	J/mol×K	298.00	NIST
Cp,liquid	232.08	J/mol×K	298.15	NIST
Cp,liquid	232.20	J/mol×K	298.15	NIST
Cp,liquid	232.20	J/mol×K	298.15	NIST
Cp,liquid	232.00	J/mol×K	298.15	NIST
Cp,liquid	220.06	J/mol×K	298.15	NIST
Cp,liquid	219.00	J/mol×K	310.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	219.20	J/mol×K	311.00	NIST
Cp,liquid	251.00	J/mol×K	313.00	NIST
Cp,liquid	225.00	J/mol×K	320.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	231.00	J/mol×K	330.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	237.00	J/mol×K	340.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	243.00	J/mol×K	350.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	249.00	J/mol×K	360.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	254.90	J/mol×K	370.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	260.90	J/mol×K	380.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	266.90	J/mol×K	390.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	272.90	J/mol×K	400.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	278.90	J/mol×K	410.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
Cp,liquid	284.80	J/mol×K	420.00	Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD
ΔfusH	[2.21; 14.41]	kJ/mol	[230.10; 242.78]
ΔfusH	2.21	kJ/mol	230.10	NIST
ΔfusH	14.41	kJ/mol	242.78	NIST
ρl	[826.61; 880.46]	kg/m3	[293.15; 363.15]
ρl	880.46	kg/m3	293.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	876.72	kg/m3	298.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	872.96	kg/m3	303.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	865.43	kg/m3	313.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	857.01	kg/m3	323.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	849.45	kg/m3	333.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	841.87	kg/m3	343.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	834.26	kg/m3	353.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	826.61	kg/m3	363.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ΔfusS	[9.60; 59.37]	J/mol×K	[230.10; 242.78]
ΔfusS	9.60	J/mol×K	230.10	NIST
ΔfusS	59.37	J/mol×K	242.78	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[151.17; 501.83]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.27170e+02
Coefficient B			1.21720e+00
Coefficient C			-7.75000e-04
Coefficient D			1.86800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	151.17	J/mol×K	273.00	Calculated Property
Cp,gas	214.72	J/mol×K	353.78	Calculated Property
Cp,gas	270.75	J/mol×K	434.56	Calculated Property
Cp,gas	319.84	J/mol×K	515.33	Calculated Property
Cp,gas	362.59	J/mol×K	596.11	Calculated Property
Cp,gas	399.58	J/mol×K	676.89	Calculated Property
Cp,gas	431.41	J/mol×K	757.67	Calculated Property
Cp,gas	458.67	J/mol×K	838.44	Calculated Property
Cp,gas	481.95	J/mol×K	919.22	Calculated Property
Cp,gas	501.83	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0524483; 0.0004194]	Pa×s	[149.00; 451.55]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.01549e+01
Coefficient B			1.07384e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			149.00
Temperature range, max.			451.55
η	0.0524483	Pa×s	149.00	Calculated Property
η	0.0139173	Pa×s	182.62	Calculated Property
η	0.0055787	Pa×s	216.23	Calculated Property
η	0.0028599	Pa×s	249.85	Calculated Property
η	0.0017179	Pa×s	283.47	Calculated Property
η	0.0011496	Pa×s	317.08	Calculated Property
η	0.0008310	Pa×s	350.70	Calculated Property
η	0.0006357	Pa×s	384.32	Calculated Property
η	0.0005078	Pa×s	417.94	Calculated Property
η	0.0004194	Pa×s	451.55	Calculated Property

Similar Compounds

Find more compounds similar to Naphthalene, decahydro-.

Mixtures

• Carbon dioxide + Naphthalene, decahydro- + Water
• Naphthalene, decahydro- + Water
• n-Hexatriacontane + Naphthalene, decahydro-
• Naphthalene, 1-methyl- + n-Hexatriacontane + Naphthalene, decahydro-
• n-Hexatriacontane + Naphthalene, decahydro- + Diethyl disulfide
• Diisopropyl ether + Naphthalene, decahydro-
• Naphthalene, decahydro- + Tricyclo[3.3.1.13,7]decane, 1,3-dimethyl-
• Propane + Naphthalene, decahydro-

Sources

• PSRK revision IV (2005), critical constants and acentric factors of 1000 components ChEDL chemicals 1.5.2, from Horstmann, S.; Jabłoniec, A.; Krafczyk, J.; Fischer, K.; Gmehling, J. PSRK Group Contribution Equation of State: Comprehensive Revision and Extension IV, Including Critical Constants and α-Function Parameters for 1000 Components. Fluid Phase Equilib. 2005, 227, 157-164.
• Cheméo Relay (1.0)
• Crippen Method
• Experimental solubility data of various n-alkane waxes: effects of alkane chain length, alkane odd versus even carbon number structures, and solvent chemistry on solubility
• Measurement and correlation of phase equilibria for (water + aromatic hydrocarbon) binary mixtures at T = (573 to 623) K using microfluidic mixing
• Effect of water content on the equilibrium pressure of (carbon dioxide + decane and + decalin) from T = (313.15 to 333.15) K
• Excess volumes, densities, speeds of sound and viscosities for the binary systems of diisopropyl ether with hydrocarbons at 303.15K
• High -Pressure Phase Diagrams of Propane + Decahydronaphthalene and Propane + Naphthalene Mixtures
• Mutual Solubilities for Water-o-Nitrotoluene System and Distribution Coefficients for Furfural and Acetic Acid in Water-o-Nitrotoluene System
• Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
• Joback Method
• Estimated Solubility Method
• McGowan Method
• NIST Webbook
• Zabransky, M., Ruzicka, V., Majer, V. and Domalski, E. (1997), Heat Capacity of Liquids: Critical Review and Recommended Values - Monograph No. 6, J. Phys. & Chem. Ref. Data (JPCRD), National Institute of Standards and Technology, Gaithersburg, MD

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