Chemical Properties of 2-isobutyladamantane

InChI

InChI=1S/C14H24/c1-9(2)3-14-12-5-10-4-11(7-12)8-13(14)6-10/h9-14H,3-8H2,1-2H3/t10-,11?,12+,13-,14?

InChI Key

MEVUXHARANYDNT-PWHQIARISA-N

Formula

C14H24

SMILES

CC(C)CC1C2CC3CC(C2)CC1C3

Molecular Weight¹

192.34

• 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).
• 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°	219.29	kJ/mol	Joback Calculated Property
ΔfH°gas	-166.01	kJ/mol	Joback Calculated Property
ΔfusH°	22.94	kJ/mol	Joback Calculated Property
ΔvapH°	45.66	kJ/mol	Joback Calculated Property
log10WS	-3.92		Crippen Calculated Property
logPoct/wat	4.105		Crippen Calculated Property
McVol	175.540	ml/mol	McGowan Calculated Property
Pc	2056.76	kPa	Joback Calculated Property
Inp	[1408.00; 1473.00]
Inp	1453.00		NIST
Inp	Outlier 1473.00		NIST
Inp	1408.00		NIST
Inp	1415.00		NIST
Inp	1416.00		NIST
Inp	1423.00		NIST
Inp	1415.00		NIST
Inp	1423.00		NIST
Inp	1432.00		NIST
Inp	1416.00		NIST
Inp	1429.00		NIST
Inp	1440.00		NIST
Inp	1453.00		NIST
I	[1581.00; 1623.00]
I	1581.00		NIST
I	1604.00		NIST
I	1623.00		NIST
Tboil	534.43	K	Joback Calculated Property
Tc	740.27	K	Joback Calculated Property
Tfus	274.36	K	Joback Calculated Property
Vc	0.674	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[469.51; 591.80]	J/mol×K	[534.43; 740.27]
Cp,gas	469.51	J/mol×K	534.43	Joback Calculated Property
Cp,gas	493.24	J/mol×K	568.74	Joback Calculated Property
Cp,gas	515.51	J/mol×K	603.04	Joback Calculated Property
Cp,gas	536.42	J/mol×K	637.35	Joback Calculated Property
Cp,gas	556.04	J/mol×K	671.65	Joback Calculated Property
Cp,gas	574.47	J/mol×K	705.96	Joback Calculated Property
Cp,gas	591.80	J/mol×K	740.27	Joback Calculated Property
η	[0.0012042; 0.0016080]	Pa×s	[274.36; 534.43]
η	0.0012042	Pa×s	274.36	Joback Calculated Property
η	0.0013059	Pa×s	317.70	Joback Calculated Property
η	0.0013889	Pa×s	361.05	Joback Calculated Property
η	0.0014578	Pa×s	404.39	Joback Calculated Property
η	0.0015158	Pa×s	447.74	Joback Calculated Property
η	0.0015653	Pa×s	491.08	Joback Calculated Property
η	0.0016080	Pa×s	534.43	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-isobutyladamantane.

Sources

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

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.