Chemical Properties of trans-Verbenyl caprate

InChI

InChI=1S/C20H34O2/c1-5-6-7-8-9-10-11-12-19(21)22-18-13-15(2)16-14-17(18)20(16,3)4/h13,16-18H,5-12,14H2,1-4H3

InChI Key

XMOYMWIGBAEZME-UHFFFAOYSA-N

Formula

C20H34O2

SMILES

CCCCCCCCCC(=O)OC1C=C(C)C2CC1C2(C)C

Molecular Weight¹

306.48

• 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.
• 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°	-7.58	kJ/mol	Joback Calculated Property
ΔfH°gas	-540.62	kJ/mol	Joback Calculated Property
ΔfusH°	41.19	kJ/mol	Joback Calculated Property
ΔvapH°	68.45	kJ/mol	Joback Calculated Property
log10WS	-6.09		Crippen Calculated Property
logPoct/wat	5.661		Crippen Calculated Property
McVol	274.080	ml/mol	McGowan Calculated Property
Pc	1269.16	kPa	Joback Calculated Property
Inp	[2072.50; 2072.50]
Inp	2072.50		NIST
Inp	2072.50		NIST
Tboil	746.08	K	Joback Calculated Property
Tc	938.16	K	Joback Calculated Property
Tfus	448.38	K	Joback Calculated Property
Vc	1.067	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[858.00; 972.35]	J/mol×K	[746.08; 938.16]
Cp,gas	858.00	J/mol×K	746.08	Joback Calculated Property
Cp,gas	878.64	J/mol×K	778.09	Joback Calculated Property
Cp,gas	898.51	J/mol×K	810.11	Joback Calculated Property
Cp,gas	917.71	J/mol×K	842.12	Joback Calculated Property
Cp,gas	936.34	J/mol×K	874.14	Joback Calculated Property
Cp,gas	954.52	J/mol×K	906.15	Joback Calculated Property
Cp,gas	972.35	J/mol×K	938.16	Joback Calculated Property

Similar Compounds

Find more compounds similar to trans-Verbenyl caprate.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.