Chemical Properties of Tricyclo[3.3.1.13,7]decane, 1,3-dimethyl-

InChI

InChI=1S/C12H20/c1-11-4-9-3-10(5-11)7-12(2,6-9)8-11/h9-10H,3-8H2,1-2H3

InChI Key

CWNOIUTVJRWADX-UHFFFAOYSA-N

Formula

C12H20

SMILES

CC12CC3CC(C1)CC(C)(C3)C2

Molecular Weight¹

164.29

Other Names

• 1,3-dimethyladamantane
• 1,3-dimethyltricyclo[3.3.1.1(3,7)]decane
• 1,3-dimethyltricyclo[3.3.1.13,7]decane
• tricyclo[3.3.1.1(3,7)]decane, 1,3-dimethyl-

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase 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_subH° : Enthalpy of sublimation 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).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• ρ_c : Critical density (kg/m³).
• ρ_l : Liquid Density (kg/m³).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔcH°solid	-7294.00 ± 3.00	kJ/mol	NIST
ΔfH°gas	-219.00 ± 3.00	kJ/mol	NIST
ΔfH°solid	-287.00 ± 3.00	kJ/mol	NIST
ΔfusH°	9.31	kJ/mol	The low-temperature heat capacities, phase transitions and thermodynamic properties of 1,3-dimethyladamantane and 1-ethyladamantane
ΔsubH°	[67.80; 68.00]	kJ/mol
ΔsubH°	68.00 ± 1.00	kJ/mol	NIST
ΔsubH°	68.00	kJ/mol	NIST
ΔsubH°	67.80 ± 1.30	kJ/mol	NIST
ΔvapH°	[49.40; 49.70]	kJ/mol
ΔvapH°	49.70 ± 0.20	kJ/mol	NIST
ΔvapH°	49.40 ± 0.30	kJ/mol	NIST
IE	9.15	eV	NIST
logPoct/wat	3.613		Crippen Calculated Property
McVol	147.360	ml/mol	McGowan Calculated Property
Pc	3000.00 ± 250.00	kPa	NIST
ρc	287.50 ± 11.99	kg/m3	NIST
Inp	[1130.00; 1194.00]
Inp	1184.00		NIST
Inp	1130.00		NIST
Inp	1136.00		NIST
Inp	1144.00		NIST
Inp	1154.00		NIST
Inp	1130.00		NIST
Inp	1194.00		NIST
Inp	1136.00		NIST
Inp	1144.00		NIST
Inp	1154.00		NIST
Inp	1151.00		NIST
Inp	1163.00		NIST
Inp	1174.00		NIST
Inp	1184.00		NIST
Inp	1171.00		NIST
Inp	1171.00		NIST
Inp	1151.00		NIST
Inp	1151.00		NIST
I	[1296.00; 1331.00]
I	1296.00		NIST
I	1296.00		NIST
I	1310.00		NIST
I	1331.00		NIST
Tboil	471.00 ± 4.00	K	NIST
Tc	708.00 ± 2.00	K	NIST
Tfus	245.00 ± 0.50	K	NIST

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[368.32; 479.22]	J/mol×K	[494.26; 720.37]
Cp,gas	368.32	J/mol×K	494.26	Joback Calculated Property
Cp,gas	390.80	J/mol×K	531.94	Joback Calculated Property
Cp,gas	411.27	J/mol×K	569.63	Joback Calculated Property
Cp,gas	430.04	J/mol×K	607.31	Joback Calculated Property
Cp,gas	447.41	J/mol×K	645.00	Joback Calculated Property
Cp,gas	463.70	J/mol×K	682.68	Joback Calculated Property
Cp,gas	479.22	J/mol×K	720.37	Joback Calculated Property
ΔfusH	[0.92; 7.36]	kJ/mol	[190.50; 245.00]
ΔfusH	1.54	kJ/mol	190.50	NIST
ΔfusH	7.36	kJ/mol	221.00	NIST
ΔfusH	0.94	kJ/mol	244.00	NIST
ΔfusH	0.92	kJ/mol	245.00	NIST
ΔfusH	0.92	kJ/mol	245.00	NIST
ΔvapH	[36.40; 49.20]	kJ/mol	[308.00; 439.00]
ΔvapH	49.20 ± 0.20	kJ/mol	308.00	NIST
ΔvapH	45.90 ± 0.30	kJ/mol	439.00	NIST
ΔvapH	43.70 ± 0.30	kJ/mol	439.00	NIST
ΔvapH	41.50 ± 0.30	kJ/mol	439.00	NIST
ΔvapH	39.10 ± 0.30	kJ/mol	439.00	NIST
ΔvapH	36.40 ± 0.30	kJ/mol	439.00	NIST
ρl	[851.23; 901.65]	kg/m3	[293.15; 363.15]
ρl	901.58	kg/m3	293.15	Density, Viscosity, Refractive Index, and Surface Tension for Six Binary Systems of Adamantane Derivatives with 1-Heptanol and Cyclohexylmethanol
ρl	901.57	kg/m3	293.15	Density and Viscosity of Ternary Mixture of Cyclopentanol + exo-Tetrahydrodicyclopentadiene + 1,3-Dimethyladamantane
ρl	901.65	kg/m3	293.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	898.00	kg/m3	298.15	Density and Viscosity of Ternary Mixture of Cyclopentanol + exo-Tetrahydrodicyclopentadiene + 1,3-Dimethyladamantane
ρl	898.04	kg/m3	298.15	Density, Viscosity, Refractive Index, and Surface Tension for Six Binary Systems of Adamantane Derivatives with 1-Heptanol and Cyclohexylmethanol
ρl	898.09	kg/m3	298.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	894.53	kg/m3	303.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	894.43	kg/m3	303.15	Density and Viscosity of Ternary Mixture of Cyclopentanol + exo-Tetrahydrodicyclopentadiene + 1,3-Dimethyladamantane
ρl	894.48	kg/m3	303.15	Density, Viscosity, Refractive Index, and Surface Tension for Six Binary Systems of Adamantane Derivatives with 1-Heptanol and Cyclohexylmethanol
ρl	890.86	kg/m3	308.15	Density and Viscosity of Ternary Mixture of Cyclopentanol + exo-Tetrahydrodicyclopentadiene + 1,3-Dimethyladamantane
ρl	890.92	kg/m3	308.15	Density, Viscosity, Refractive Index, and Surface Tension for Six Binary Systems of Adamantane Derivatives with 1-Heptanol and Cyclohexylmethanol
ρl	887.41	kg/m3	313.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	887.35	kg/m3	313.15	Density, Viscosity, Refractive Index, and Surface Tension for Six Binary Systems of Adamantane Derivatives with 1-Heptanol and Cyclohexylmethanol
ρl	887.29	kg/m3	313.15	Density and Viscosity of Ternary Mixture of Cyclopentanol + exo-Tetrahydrodicyclopentadiene + 1,3-Dimethyladamantane
ρl	883.77	kg/m3	318.15	Density, Viscosity, Refractive Index, and Surface Tension for Six Binary Systems of Adamantane Derivatives with 1-Heptanol and Cyclohexylmethanol
ρl	883.71	kg/m3	318.15	Density and Viscosity of Ternary Mixture of Cyclopentanol + exo-Tetrahydrodicyclopentadiene + 1,3-Dimethyladamantane
ρl	880.13	kg/m3	323.15	Density and Viscosity of Ternary Mixture of Cyclopentanol + exo-Tetrahydrodicyclopentadiene + 1,3-Dimethyladamantane
ρl	880.17	kg/m3	323.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	880.19	kg/m3	323.15	Density, Viscosity, Refractive Index, and Surface Tension for Six Binary Systems of Adamantane Derivatives with 1-Heptanol and Cyclohexylmethanol
ρl	876.55	kg/m3	328.15	Density and Viscosity of Ternary Mixture of Cyclopentanol + exo-Tetrahydrodicyclopentadiene + 1,3-Dimethyladamantane
ρl	876.60	kg/m3	328.15	Density, Viscosity, Refractive Index, and Surface Tension for Six Binary Systems of Adamantane Derivatives with 1-Heptanol and Cyclohexylmethanol
ρl	872.96	kg/m3	333.15	Density and Viscosity of Ternary Mixture of Cyclopentanol + exo-Tetrahydrodicyclopentadiene + 1,3-Dimethyladamantane
ρl	872.99	kg/m3	333.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	873.01	kg/m3	333.15	Density, Viscosity, Refractive Index, and Surface Tension for Six Binary Systems of Adamantane Derivatives with 1-Heptanol and Cyclohexylmethanol
ρl	865.77	kg/m3	343.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	858.52	kg/m3	353.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	851.23	kg/m3	363.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ΔfusS	[3.76; 33.30]	J/mol×K	[221.00; 245.00]
ΔfusS	33.30	J/mol×K	221.00	NIST
ΔfusS	3.76	J/mol×K	245.00	NIST

Similar Compounds

Find more compounds similar to Tricyclo[3.3.1.13,7]decane, 1,3-dimethyl-.

Mixtures

• Decane + Tricyclo[3.3.1.13,7]decane, 1,3-dimethyl-
• Tricyclo[3.3.1.13,7]decane, 1,3-dimethyl- + BUTYLCYCLOHEXANE
• Naphthalene, decahydro- + Tricyclo[3.3.1.13,7]decane, 1,3-dimethyl-
• Adamantane + Tricyclo[3.3.1.13,7]decane, 1,3-dimethyl-
• Cyclopentanol + Tricyclo[3.3.1.13,7]decane, 1,3-dimethyl-
• Tricyclo[3.3.1.13,7]decane, 1,3-dimethyl- + 4,7-Methano-1H-indene, octahydro-
• Cyclopentanol + Tricyclo[3.3.1.13,7]decane, 1,3-dimethyl- + 4,7-Methano-1H-indene, octahydro-
• Cyclohexanemethanol + Tricyclo[3.3.1.13,7]decane, 1,3-dimethyl-

Sources

• Crippen Method
• Crippen Method
• The low-temperature heat capacities, phase transitions and thermodynamic properties of 1,3-dimethyladamantane and 1-ethyladamantane
• Density and Viscosity of Ternary Mixture of Cyclopentanol + exo-Tetrahydrodicyclopentadiene + 1,3-Dimethyladamantane
• Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
• Density, Viscosity, Refractive Index, and Surface Tension for Six Binary Systems of Adamantane Derivatives with 1-Heptanol and Cyclohexylmethanol
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.