Chemical Properties of methyl 3-methylenepentanoate

InChI

InChI=1S/C7H12O2/c1-4-6(2)5-7(8)9-3/h2,4-5H2,1,3H3

InChI Key

HTXYSYBDRBAXBK-UHFFFAOYSA-N

Formula

C7H12O2

SMILES

C=C(CC)CC(=O)OC

Molecular Weight¹

128.17

• 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 : 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°	-146.57	kJ/mol	Joback Calculated Property
ΔfH°gas	-316.97	kJ/mol	Joback Calculated Property
ΔfusH°	14.08	kJ/mol	Joback Calculated Property
ΔvapH°	39.74	kJ/mol	Joback Calculated Property
log10WS	-1.47		Crippen Calculated Property
logPoct/wat	1.516		Crippen Calculated Property
McVol	112.630	ml/mol	McGowan Calculated Property
Pc	3096.73	kPa	Joback Calculated Property
I	[1200.00; 1200.00]
I	1200.00		NIST
I	1200.00		NIST
Tboil	432.41	K	Joback Calculated Property
Tc	615.89	K	Joback Calculated Property
Tfus	225.09	K	Joback Calculated Property
Vc	0.433	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[222.80; 280.72]	J/mol×K	[432.41; 615.89]
Cp,gas	222.80	J/mol×K	432.41	Joback Calculated Property
Cp,gas	233.44	J/mol×K	462.99	Joback Calculated Property
Cp,gas	243.68	J/mol×K	493.57	Joback Calculated Property
Cp,gas	253.52	J/mol×K	524.15	Joback Calculated Property
Cp,gas	262.97	J/mol×K	554.73	Joback Calculated Property
Cp,gas	272.04	J/mol×K	585.31	Joback Calculated Property
Cp,gas	280.72	J/mol×K	615.89	Joback Calculated Property

Similar Compounds

Find more compounds similar to methyl 3-methylenepentanoate.

Sources

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

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