Chemical Properties of Vinyl 2-ethylhexanoate (CAS 94-04-2)

InChI

InChI=1S/C10H18O2/c1-4-7-8-9(5-2)10(11)12-6-3/h6,9H,3-5,7-8H2,1-2H3

InChI Key

IGBZOHMCHDADGY-UHFFFAOYSA-N

Formula

C10H18O2

SMILES

C=COC(=O)C(CC)CCCC

Molecular Weight¹

170.25

CAS

94-04-2

Other Names

• 2-Ethylhexanoic acid, vinyl ester
• 2-Ethylhexoic acid, vinyl ester
• Hexanoic acid, 2-ethyl-, ethenyl ester
• Hexanoic acid, 2-ethyl-, vinyl ester
• Vinyl 2-ethylhexoate
• Vinylester kyseliny 2-ethylkapronove

• ω : Acentric Factor.
• 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).
• 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).
• P_vap : Vapor pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[350.06; 425.43]	J/mol×K	[500.73; 679.83]
Cp,gas	350.06	J/mol×K	500.73	Joback Calculated Property
Cp,gas	364.01	J/mol×K	530.58	Joback Calculated Property
Cp,gas	377.40	J/mol×K	560.43	Joback Calculated Property
Cp,gas	390.22	J/mol×K	590.28	Joback Calculated Property
Cp,gas	402.50	J/mol×K	620.13	Joback Calculated Property
Cp,gas	414.23	J/mol×K	649.98	Joback Calculated Property
Cp,gas	425.43	J/mol×K	679.83	Joback Calculated Property
η	[0.0002145; 0.0042919]	Pa×s	[257.86; 500.73]
η	0.0042919	Pa×s	257.86	Joback Calculated Property
η	0.0018562	Pa×s	298.34	Joback Calculated Property
η	0.0009808	Pa×s	338.82	Joback Calculated Property
η	0.0005939	Pa×s	379.29	Joback Calculated Property
η	0.0003961	Pa×s	419.77	Joback Calculated Property
η	0.0002837	Pa×s	460.25	Joback Calculated Property
η	0.0002145	Pa×s	500.73	Joback Calculated Property

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.63]	kPa	[344.10; 519.38]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.32411e+01
Coefficient B			-3.58384e+03
Coefficient C			-6.74310e+01
Temperature range, min.			344.10
Temperature range, max.			519.38
Pvap	1.33	kPa	344.10	Calculated Property
Pvap	3.13	kPa	363.58	Calculated Property
Pvap	6.59	kPa	383.05	Calculated Property
Pvap	12.76	kPa	402.53	Calculated Property
Pvap	22.96	kPa	422.00	Calculated Property
Pvap	38.86	kPa	441.48	Calculated Property
Pvap	62.43	kPa	460.95	Calculated Property
Pvap	95.92	kPa	480.43	Calculated Property
Pvap	141.78	kPa	499.90	Calculated Property
Pvap	202.63	kPa	519.38	Calculated Property

Similar Compounds

Find more compounds similar to Vinyl 2-ethylhexanoate.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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