Chemical Properties of Adamantane (CAS 281-23-2)

InChI

InChI=1S/C10H16/c1-7-2-9-4-8(1)5-10(3-7)6-9/h7-10H,1-6H2

InChI Key

ORILYTVJVMAKLC-UHFFFAOYSA-N

Formula

C10H16

SMILES

C1C2CC3CC1CC(C2)C3

Molecular Weight¹

136.23

CAS

281-23-2

Other Names

• 4,7-methano-1H-indene, octahydro-, (3a.alpha.,4.beta.,7.beta.,7a.alpha.)-
• 4,7-methanoindan, hexahydro-, exo-
• JP-10
• Tricyclo(3,3,1,1,
• exo-3,4,8,9-tetrahydrodicyclopentadiene
• exo-5,6-trimethylenenorbornane
• exo-octahydro-4,7-methano-1H-indene
• exo-tetrahydrobicyclopentadiene
• exo-tetrahydrodicyclopentadiene
• exo-tricyclo[5.2.1.02,6]decane
• exo-trimethylenenorbornane
• jp10
• tricyclo[3.3.1.1(3,7)]decane

• ω : Acentric Factor.
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,solid : Solid phase 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_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 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.
• I : Polar retention indices.
• S°_{solid,1 bar} : Solid 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	0.3311		Relay (1.0) Calculated Property
ΔcH°solid	[-6033.40; -6024.50]	kJ/mol
ΔcH°solid	-6029.00 ± 4.00	kJ/mol	NIST
ΔcH°solid	-6033.10 ± 2.80	kJ/mol	NIST
ΔcH°solid	-6033.40 ± 3.30	kJ/mol	NIST
ΔcH°solid	-6024.50 ± 0.71	kJ/mol	NIST
ΔfG°	195.76	kJ/mol	Joback Calculated Property
ΔfH°gas	[-138.70; -129.00]	kJ/mol
ΔfH°gas	-134.40 ± 2.30	kJ/mol	NIST
ΔfH°gas	-138.70	kJ/mol	NIST
ΔfH°gas	-133.60 ± 2.50	kJ/mol	NIST
ΔfH°gas	-129.00 ± 4.00	kJ/mol	NIST
ΔfH°gas	-137.90 ± 0.79	kJ/mol	NIST
ΔfH°solid	[-197.20; -188.40]	kJ/mol
ΔfH°solid	-192.50 ± 0.40	kJ/mol	NIST
ΔfH°solid	-193.80	kJ/mol	NIST
ΔfH°solid	-188.70 ± 2.80	kJ/mol	NIST
ΔfH°solid	-188.40 ± 3.30	kJ/mol	NIST
ΔfH°solid	-197.20 ± 0.79	kJ/mol	NIST
ΔfusH°	3.09	kJ/mol	Redetermination of the thermodynamic properties of the solid solid transition of adamantane by adiabatic calorimetry to investigate the suitability as a reference material for low-temperature DSC-calibration
ΔvapH°	[48.20; 51.70]	kJ/mol
ΔvapH°	48.20	kJ/mol	NIST
ΔvapH°	51.70	kJ/mol	NIST
IE	[9.10; 9.75]	eV
IE	9.25 ± 0.04	eV	NIST
IE	9.20	eV	NIST
IE	9.25	eV	NIST
IE	9.23	eV	NIST
IE	9.10 ± 0.05	eV	NIST
IE	9.30 ± 0.10	eV	NIST
IE	9.31 ± 0.01	eV	NIST
IE	9.30 ± 0.01	eV	NIST
IE	9.22	eV	NIST
IE	9.25	eV	NIST
IE	9.75	eV	NIST
IE	9.28	eV	NIST
IE	9.75 ± 0.02	eV	NIST
IE	9.75	eV	NIST
IE	9.55	eV	NIST
log10WS	-5.66		Relay (1.0) Calculated Property
logPoct/wat	2.833		Crippen Calculated Property
McVol	119.180	ml/mol	McGowan Calculated Property
Pc	3100.18	kPa	Joback Calculated Property
Inp	[1076.00; 1153.00]
Inp	1121.00		NIST
Inp	1117.00		NIST
Inp	1120.00		NIST
Inp	1120.00		NIST
Inp	1136.90		NIST
Inp	1149.00		NIST
Inp	1116.00		NIST
Inp	1116.00		NIST
Inp	1116.00		NIST
Inp	1149.00		NIST
Inp	1135.30		NIST
Inp	1095.20		NIST
Inp	1113.00		NIST
Inp	1117.00		NIST
Inp	1120.00		NIST
Inp	1118.00		NIST
Inp	1116.00		NIST
Inp	1095.00		NIST
Inp	1104.00		NIST
Inp	1114.00		NIST
Inp	1116.00		NIST
Inp	1117.00		NIST
Inp	1120.00		NIST
Inp	1125.00		NIST
Inp	1120.00		NIST
Inp	1128.00		NIST
Inp	1131.00		NIST
Inp	1130.00		NIST
Inp	1095.00		NIST
Inp	1104.00		NIST
Inp	1114.00		NIST
Inp	1118.00		NIST
Inp	1132.00		NIST
Inp	1143.00		NIST
Inp	Outlier 1153.00		NIST
Inp	1123.00		NIST
Inp	1123.00		NIST
Inp	Outlier 1076.00		NIST
Inp	1118.00		NIST
Inp	1118.00		NIST
Inp	1144.00		NIST
Inp	Outlier 1076.00		NIST
I	[1320.00; 1400.00]
I	1400.00		NIST
I	1325.00		NIST
I	1325.00		NIST
I	1363.00		NIST
I	1320.00		NIST
I	1339.00		NIST
I	1363.00		NIST
I	1400.00		NIST
I	1363.00		NIST
I	1400.00		NIST
S°solid,1 bar	[195.83; 195.83]	J/mol×K
S°solid,1 bar	195.83	J/mol×K	NIST
S°solid,1 bar	195.83	J/mol×K	NIST
Tboil	471.37	K	Relay (1.0) Calculated Property
Tc	705.18	K	Relay (1.0) Calculated Property
Tfus	[542.15; 552.00]	K
Tfus	552.00 ± 3.00	K	NIST
Tfus	542.15 ± 1.00	K	NIST
Vc	0.457	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[272.54; 378.92]	J/mol×K	[448.02; 661.62]
Cp,gas	272.54	J/mol×K	448.02	Joback Calculated Property
Cp,gas	293.60	J/mol×K	483.62	Joback Calculated Property
Cp,gas	313.20	J/mol×K	519.22	Joback Calculated Property
Cp,gas	331.44	J/mol×K	554.82	Joback Calculated Property
Cp,gas	348.41	J/mol×K	590.42	Joback Calculated Property
Cp,gas	364.21	J/mol×K	626.02	Joback Calculated Property
Cp,gas	378.92	J/mol×K	661.62	Joback Calculated Property
Cp,solid	[189.74; 189.74]	J/mol×K	[298.15; 298.15]
Cp,solid	189.74	J/mol×K	298.15	NIST
Cp,solid	189.74	J/mol×K	298.15	NIST
η	[0.0006121; 0.0011052]	Pa×s	[248.52; 448.02]
η	0.0006121	Pa×s	248.52	Joback Calculated Property
η	0.0007158	Pa×s	281.77	Joback Calculated Property
η	0.0008100	Pa×s	315.02	Joback Calculated Property
η	0.0008951	Pa×s	348.27	Joback Calculated Property
η	0.0009721	Pa×s	381.52	Joback Calculated Property
η	0.0010419	Pa×s	414.77	Joback Calculated Property
η	0.0011052	Pa×s	448.02	Joback Calculated Property
ΔfusH	[10.90; 13.80]	kJ/mol	[541.00; 543.20]
ΔfusH	10.90	kJ/mol	541.00	NIST
ΔfusH	10.90	kJ/mol	541.20	NIST
ΔfusH	13.80	kJ/mol	543.20	NIST
ΔsubH	[53.60; 59.70]	kJ/mol	[308.00; 413.00]
ΔsubH	58.30	kJ/mol	308.00	NIST
ΔsubH	59.70	kJ/mol	323.00	NIST
ΔsubH	59.70 ± 0.80	kJ/mol	323.00	NIST
ΔsubH	59.30 ± 0.20	kJ/mol	323.00	NIST
ΔsubH	58.60 ± 0.60	kJ/mol	333.00	NIST
ΔsubH	53.60	kJ/mol	339.00	NIST
ΔsubH	55.30	kJ/mol	350.50	NIST
ΔsubH	59.50	kJ/mol	360.50	NIST
ΔsubH	54.30	kJ/mol	413.00	NIST
ρl	[880.32; 935.74]	kg/m3	[293.15; 363.15]
ρl	935.74	kg/m3	293.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	931.86	kg/m3	298.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	927.95	kg/m3	303.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	920.13	kg/m3	313.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	912.14	kg/m3	323.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	904.25	kg/m3	333.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	896.32	kg/m3	343.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	888.34	kg/m3	353.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
ρl	880.32	kg/m3	363.15	Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes

Similar Compounds

Find more compounds similar to Adamantane.

Mixtures

• Adamantane + Adamantane, 1,3-dimethyl-
• Adamantane + Water

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Infinite dilution activity coefficients, specific retention volumes and solvation thermodynamics of hydrocarbons in C78H158 branched alkane solvent
• Redetermination of the thermodynamic properties of the solid solid transition of adamantane by adiabatic calorimetry to investigate the suitability as a reference material for low-temperature DSC-calibration
• Density, Viscosity, Surface Tension, and Refractive Index for Binary Mixtures of 1,3-Dimethyladamantane with Four C10 Alkanes
• Solubilities of Adamantane and Diamantane in Pressurized Hot Water
• Solubility of Adamantane in Phosphonium-Based Ionic Liquids
• Joback Method
• McGowan Method
• NIST Webbook

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