Chemical Properties of 3-methylbut-2-en-1-yl 3-methylbutanoate

InChI

InChI=1S/C10H18O2/c1-8(2)5-6-12-10(11)7-9(3)4/h5,9H,6-7H2,1-4H3

InChI Key

SXWCTQGESRWYMK-UHFFFAOYSA-N

Formula

C10H18O2

SMILES

CC(C)=CCOC(=O)CC(C)C

Molecular Weight¹

170.25

Other Names

• Isopentenyl isovalerate

• 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°	-131.37	kJ/mol	Joback Calculated Property
ΔfH°gas	-392.38	kJ/mol	Joback Calculated Property
ΔfusH°	19.81	kJ/mol	Joback Calculated Property
ΔvapH°	46.66	kJ/mol	Joback Calculated Property
log10WS	-2.48		Crippen Calculated Property
logPoct/wat	2.542		Crippen Calculated Property
McVol	154.900	ml/mol	McGowan Calculated Property
Pc	2340.56	kPa	Joback Calculated Property
Inp	[1103.00; 1156.00]
Inp	1156.00		NIST
Inp	1146.00		NIST
Inp	1103.00		NIST
Inp	1156.00		NIST
Inp	1103.00		NIST
Inp	1146.00		NIST
Tboil	508.09	K	Joback Calculated Property
Tc	694.82	K	Joback Calculated Property
Tfus	240.58	K	Joback Calculated Property
Vc	0.595	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[350.82; 427.88]	J/mol×K	[508.09; 694.82]
Cp,gas	350.82	J/mol×K	508.09	Joback Calculated Property
Cp,gas	365.21	J/mol×K	539.21	Joback Calculated Property
Cp,gas	378.95	J/mol×K	570.33	Joback Calculated Property
Cp,gas	392.08	J/mol×K	601.46	Joback Calculated Property
Cp,gas	404.60	J/mol×K	632.58	Joback Calculated Property
Cp,gas	416.53	J/mol×K	663.70	Joback Calculated Property
Cp,gas	427.88	J/mol×K	694.82	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-methylbut-2-en-1-yl 3-methylbutanoate.

Sources

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

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