Chemical Properties of Cyclopropanecarboxylic acid, trans-2-phenyl-, 3-methylbut-2-yl ester

InChI

InChI=1S/C15H20O2/c1-10(2)11(3)17-15(16)14-9-13(14)12-7-5-4-6-8-12/h4-8,10-11,13-14H,9H2,1-3H3

InChI Key

ZUODJYREEXRIQB-UHFFFAOYSA-N

Formula

C15H20O2

SMILES

CC(C)C(C)OC(=O)C1CC1c1ccccc1

Molecular Weight¹

232.32

• 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).
• 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
ω	0.5191		Relay (... Calculated Property
ΔfG°	2.07	kJ/mol	Joback Calculated Property
ΔfH°gas	-339.20	kJ/mol	Relay (... Calculated Property
ΔfusH°	23.59	kJ/mol	Joback Calculated Property
ΔvapH°	75.79	kJ/mol	Relay (... Calculated Property
IE	8.81	eV	Relay (... Calculated Property
log10WS	-3.80		Relay (... Calculated Property
logPoct/wat	3.378		Crippen Calculated Property
McVol	195.030	ml/mol	McGowan Calculated Property
Pc	2127.56	kPa	Joback Calculated Property
Inp	[1709.00; 1709.00]
Inp	1709.00		NIST
Inp	1709.00		NIST
Tboil	545.05	K	Relay (... Calculated Property
Tc	787.22	K	Relay (... Calculated Property
Tfus	289.93	K	Relay (... Calculated Property
Vc	0.714	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[534.81; 628.88]	J/mol×K	[646.76; 865.01]
Cp,gas	534.81	J/mol×K	646.76	Joback Calculated Property
Cp,gas	553.32	J/mol×K	683.14	Joback Calculated Property
Cp,gas	570.62	J/mol×K	719.51	Joback Calculated Property
Cp,gas	586.77	J/mol×K	755.89	Joback Calculated Property
Cp,gas	601.82	J/mol×K	792.26	Joback Calculated Property
Cp,gas	615.84	J/mol×K	828.64	Joback Calculated Property
Cp,gas	628.88	J/mol×K	865.01	Joback Calculated Property
η	[0.0003542; 0.0025930]	Pa×s	[341.09; 646.76]
η	0.0025930	Pa×s	341.09	Joback Calculated Property
η	0.0015000	Pa×s	392.04	Joback Calculated Property
η	0.0009842	Pa×s	442.98	Joback Calculated Property
η	0.0007044	Pa×s	493.93	Joback Calculated Property
η	0.0005366	Pa×s	544.87	Joback Calculated Property
η	0.0004283	Pa×s	595.82	Joback Calculated Property
η	0.0003542	Pa×s	646.76	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclopropanecarboxylic acid, trans-2-phenyl-, 3-methylbut-2-yl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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