Chemical Properties of Cyclopropanecarboxylic acid, 4-methoxy-2-methylbutyl ester

InChI

InChI=1S/C10H18O3/c1-8(5-6-12-2)7-13-10(11)9-3-4-9/h8-9H,3-7H2,1-2H3

InChI Key

ZDAXWKATNIUDLK-UHFFFAOYSA-N

Formula

C10H18O3

SMILES

COCCC(C)COC(=O)C1CC1

Molecular Weight¹

186.25

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-615.66	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	21.82	kJ/mol	Joback Calculated Property
ΔvapH°	61.41	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	1.612		Crippen Calculated Property
McVol	154.210	ml/mol	McGowan Calculated Property
Inp	[1317.00; 1317.00]
Inp	1317.00		NIST
Inp	1317.00		NIST
Tboil	507.84	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[374.41; 456.53]	J/mol×K	[515.34; 700.10]
Cp,gas	374.41	J/mol×K	515.34	Joback Calculated Property
Cp,gas	389.86	J/mol×K	546.13	Joback Calculated Property
Cp,gas	404.58	J/mol×K	576.93	Joback Calculated Property
Cp,gas	418.59	J/mol×K	607.72	Joback Calculated Property
Cp,gas	431.91	J/mol×K	638.51	Joback Calculated Property
Cp,gas	444.55	J/mol×K	669.31	Joback Calculated Property
Cp,gas	456.53	J/mol×K	700.10	Joback Calculated Property
η	[0.0003272; 0.0031610]	Pa×s	[269.96; 515.34]
η	0.0031610	Pa×s	269.96	Joback Calculated Property
η	0.0016892	Pa×s	310.86	Joback Calculated Property
η	0.0010443	Pa×s	351.75	Joback Calculated Property
η	0.0007136	Pa×s	392.65	Joback Calculated Property
η	0.0005240	Pa×s	433.55	Joback Calculated Property
η	0.0004058	Pa×s	474.44	Joback Calculated Property
η	0.0003272	Pa×s	515.34	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclopropanecarboxylic acid, 4-methoxy-2-methylbutyl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• 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.
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