Chemical Properties of 3-(1-adamantyl)pentene-2

InChI

InChI=1S/C15H24/c1-3-14(4-2)15-8-11-5-12(9-15)7-13(6-11)10-15/h3,11-13H,4-10H2,1-2H3/b14-3-

InChI Key

IWINQLXEHRHZRS-BNNQUZSASA-N

Formula

C15H24

SMILES

CC=C(CC)C12CC3CC(CC(C3)C1)C2

Molecular Weight¹

204.35

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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°	304.04	kJ/mol	Joback Calculated Property
ΔfH°gas	-38.36	kJ/mol	Joback Calculated Property
ΔfusH°	20.58	kJ/mol	Joback Calculated Property
ΔvapH°	47.47	kJ/mol	Joback Calculated Property
log10WS	-4.67		Crippen Calculated Property
logPoct/wat	4.559		Crippen Calculated Property
McVol	185.330	ml/mol	McGowan Calculated Property
Pc	2115.83	kPa	Joback Calculated Property
Inp	[1559.00; 1600.00]
Inp	1559.00		NIST
Inp	1571.00		NIST
Inp	1587.00		NIST
Inp	1600.00		NIST
Inp	1559.00		NIST
I	[1811.00; 1854.00]
I	1811.00		NIST
I	1834.00		NIST
I	1854.00		NIST
I	1811.00		NIST
Tboil	566.70	K	Joback Calculated Property
Tc	786.31	K	Joback Calculated Property
Tfus	309.73	K	Joback Calculated Property
Vc	0.717	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[502.70; 620.62]	J/mol×K	[566.70; 786.31]
Cp,gas	502.70	J/mol×K	566.70	Joback Calculated Property
Cp,gas	525.66	J/mol×K	603.30	Joback Calculated Property
Cp,gas	547.01	J/mol×K	639.90	Joback Calculated Property
Cp,gas	566.95	J/mol×K	676.51	Joback Calculated Property
Cp,gas	585.72	J/mol×K	713.11	Joback Calculated Property
Cp,gas	603.54	J/mol×K	749.71	Joback Calculated Property
Cp,gas	620.62	J/mol×K	786.31	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-(1-adamantyl)pentene-2.

Sources

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

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