Chemical Properties of Tricyclo[3.3.1.13,7]decane, 2-ethyl- (CAS 14451-87-7)

InChI

InChI=1S/C12H20/c1-2-12-10-4-8-3-9(6-10)7-11(12)5-8/h8-12H,2-7H2,1H3

InChI Key

LIAWCKFOFPPVGF-UHFFFAOYSA-N

Formula

C12H20

SMILES

CCC1C2CC3CC(C2)CC1C3

Molecular Weight¹

164.29

CAS

14451-87-7

Other Names

• 2-Ethyladamantane

• 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).
• 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).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• 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
ΔfG°	204.89	kJ/mol	Joback Calculated Property
ΔfH°gas	-119.45	kJ/mol	Joback Calculated Property
ΔfusH°	21.28	kJ/mol	Joback Calculated Property
ΔvapH°	41.60	kJ/mol	Joback Calculated Property
IE	9.20	eV	NIST
log10WS	-3.32		Crippen Calculated Property
logPoct/wat	3.469		Crippen Calculated Property
McVol	147.360	ml/mol	McGowan Calculated Property
Pc	2448.32	kPa	Joback Calculated Property
Inp	[1258.00; 1329.00]
Inp	1323.00		NIST
Inp	1262.00		NIST
Inp	1286.00		NIST
Inp	1295.00		NIST
Inp	1284.00		NIST
Inp	1306.00		NIST
Inp	1258.00		NIST
Inp	1262.00		NIST
Inp	1270.00		NIST
Inp	1280.00		NIST
Inp	1286.00		NIST
Inp	1295.00		NIST
Inp	1306.00		NIST
Inp	1312.00		NIST
Inp	1320.00		NIST
Inp	1258.00		NIST
Inp	1329.00		NIST
Inp	1262.00		NIST
Inp	1270.00		NIST
Inp	1280.00		NIST
Inp	1284.00		NIST
Inp	1299.00		NIST
Inp	1310.00		NIST
Inp	1323.00		NIST
Inp	1265.00		NIST
Inp	1284.00		NIST
Inp	1284.00		NIST
Inp	1284.00		NIST
Inp	1323.00		NIST
Inp	1306.00		NIST
Inp	1286.00		NIST
Inp	1258.00		NIST
I	[1482.00; 1525.00]
I	1482.00		NIST
I	1505.00		NIST
I	1525.00		NIST
I	1482.00		NIST
Tboil	489.11	K	Joback Calculated Property
Tc	696.52	K	Joback Calculated Property
Tfus	266.82	K	Joback Calculated Property
Vc	0.569	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[367.52; 483.01]	J/mol×K	[489.11; 696.52]
Cp,gas	367.52	J/mol×K	489.11	Joback Calculated Property
Cp,gas	390.03	J/mol×K	523.68	Joback Calculated Property
Cp,gas	411.12	J/mol×K	558.25	Joback Calculated Property
Cp,gas	430.88	J/mol×K	592.81	Joback Calculated Property
Cp,gas	449.39	J/mol×K	627.38	Joback Calculated Property
Cp,gas	466.74	J/mol×K	661.95	Joback Calculated Property
Cp,gas	483.01	J/mol×K	696.52	Joback Calculated Property
η	[0.0007378; 0.0014315]	Pa×s	[266.82; 489.11]
η	0.0007378	Pa×s	266.82	Joback Calculated Property
η	0.0008813	Pa×s	303.87	Joback Calculated Property
η	0.0010129	Pa×s	340.92	Joback Calculated Property
η	0.0011329	Pa×s	377.96	Joback Calculated Property
η	0.0012419	Pa×s	415.01	Joback Calculated Property
η	0.0013411	Pa×s	452.06	Joback Calculated Property
η	0.0014315	Pa×s	489.11	Joback Calculated Property

Similar Compounds

Find more compounds similar to Tricyclo[3.3.1.13,7]decane, 2-ethyl-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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