Chemical Properties of 1-carbomethoxy-1-methylcyclohex-3-ene

InChI

InChI=1S/C9H14O2/c1-9(8(10)11-2)6-4-3-5-7-9/h3-4H,5-7H2,1-2H3

InChI Key

GLCJULYDLTXOEN-UHFFFAOYSA-N

Formula

C9H14O2

SMILES

COC(=O)C1(C)CC=CCC1

Molecular Weight¹

154.21

• 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 : 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	0.3328		Relay (1.0) Calculated Property
ΔfG°	-160.10	kJ/mol	Joback Calculated Property
ΔfH°gas	-362.28	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	8.61	kJ/mol	Joback Calculated Property
ΔvapH°	54.33	kJ/mol	Relay (1.0) Calculated Property
IE	9.19	eV	Relay (1.0) Calculated Property
log10WS	-1.88		Relay (1.0) Calculated Property
logPoct/wat	1.906		Crippen Calculated Property
McVol	129.950	ml/mol	McGowan Calculated Property
Pc	3265.31	kPa	Joback Calculated Property
I	[1442.00; 1458.40]
I	1442.00		NIST
I	1458.40		NIST
I	1442.00		NIST
Tboil	453.45	K	Relay (1.0) Calculated Property
Tc	654.69	K	Relay (1.0) Calculated Property
Tfus	229.40	K	Relay (1.0) Calculated Property
Vc	0.438	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[291.56; 372.87]	J/mol×K	[500.56; 720.15]
Cp,gas	291.56	J/mol×K	500.56	Joback Calculated Property
Cp,gas	307.34	J/mol×K	537.16	Joback Calculated Property
Cp,gas	322.09	J/mol×K	573.76	Joback Calculated Property
Cp,gas	335.92	J/mol×K	610.36	Joback Calculated Property
Cp,gas	348.93	J/mol×K	646.95	Joback Calculated Property
Cp,gas	361.21	J/mol×K	683.55	Joback Calculated Property
Cp,gas	372.87	J/mol×K	720.15	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-carbomethoxy-1-methylcyclohex-3-ene.

Sources

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

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