Chemical Properties of 2«alpha»-Isopropenyl-6«alpha»-isopropyl-3«alpha»-methyl-3«alpha»-vinylcyclohexanone

InChI

InChI=1S/C15H24O/c1-7-15(6)9-8-12(10(2)3)14(16)13(15)11(4)5/h7,10,12-13H,1,4,8-9H2,2-3,5-6H3/t12-,13+,15+/m0/s1

InChI Key

GWHRSRIPLDHJHR-GZBFAFLISA-N

Formula

C15H24O

SMILES

C=CC1(C)CCC(C(C)C)C(=O)C1C(=C)C

Molecular Weight¹

220.35

• ω : Acentric Factor.
• 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).
• 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.
• 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	0.3666		Relay (1.0) Calculated Property
ΔfG°	121.06	kJ/mol	Joback Calculated Property
ΔfH°gas	-215.94	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	14.40	kJ/mol	Joback Calculated Property
ΔvapH°	66.21	kJ/mol	Relay (1.0) Calculated Property
IE	8.65	eV	Relay (1.0) Calculated Property
log10WS	-3.97		Relay (1.0) Calculated Property
logPoct/wat	4.006		Crippen Calculated Property
McVol	204.320	ml/mol	McGowan Calculated Property
Pc	1823.17	kPa	Joback Calculated Property
Inp	[1522.00; 1522.00]
Inp	1522.00		NIST
Inp	1522.00		NIST
Tboil	530.90	K	Relay (1.0) Calculated Property
Tc	749.55	K	Relay (1.0) Calculated Property
Tfus	314.77	K	Relay (1.0) Calculated Property
Vc	0.666	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[552.57; 670.21]	J/mol×K	[613.67; 834.59]
Cp,gas	552.57	J/mol×K	613.67	Joback Calculated Property
Cp,gas	574.78	J/mol×K	650.49	Joback Calculated Property
Cp,gas	595.82	J/mol×K	687.31	Joback Calculated Property
Cp,gas	615.78	J/mol×K	724.13	Joback Calculated Property
Cp,gas	634.76	J/mol×K	760.95	Joback Calculated Property
Cp,gas	652.87	J/mol×K	797.77	Joback Calculated Property
Cp,gas	670.21	J/mol×K	834.59	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2«alpha»-Isopropenyl-6«alpha»-isopropyl-3«alpha»-methyl-3«alpha»-vinylcyclohexanone.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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