Chemical Properties of Cyclopropanecarboxylic acid, trans-2-phenyl-, 4-benzyloxyphenyl ester

InChI

InChI=1S/C23H20O3/c24-23(22-15-21(22)18-9-5-2-6-10-18)26-20-13-11-19(12-14-20)25-16-17-7-3-1-4-8-17/h1-14,21-22H,15-16H2

InChI Key

UXCUMQHSHUJPBT-UHFFFAOYSA-N

Formula

C23H20O3

SMILES

O=C(Oc1ccc(OCc2ccccc2)cc1)C1CC1c1ccccc1

Molecular Weight¹

344.40

• 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).
• 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°	184.50	kJ/mol	Joback Calculated Property
ΔfH°gas	-144.49	kJ/mol	Joback Calculated Property
ΔfusH°	40.24	kJ/mol	Joback Calculated Property
ΔvapH°	85.45	kJ/mol	Joback Calculated Property
log10WS	-6.08		Crippen Calculated Property
logPoct/wat	4.975		Crippen Calculated Property
McVol	266.100	ml/mol	McGowan Calculated Property
Pc	1854.71	kPa	Joback Calculated Property
Inp	[2908.00; 2908.00]
Inp	2908.00		NIST
Inp	2908.00		NIST
Tboil	911.44	K	Joback Calculated Property
Tc	1164.99	K	Joback Calculated Property
Tfus	548.84	K	Joback Calculated Property
Vc	0.998	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[829.45; 901.13]	J/mol×K	[911.44; 1164.99]
Cp,gas	829.45	J/mol×K	911.44	Joback Calculated Property
Cp,gas	844.71	J/mol×K	953.70	Joback Calculated Property
Cp,gas	858.48	J/mol×K	995.96	Joback Calculated Property
Cp,gas	870.88	J/mol×K	1038.21	Joback Calculated Property
Cp,gas	882.05	J/mol×K	1080.47	Joback Calculated Property
Cp,gas	892.09	J/mol×K	1122.73	Joback Calculated Property
Cp,gas	901.13	J/mol×K	1164.99	Joback Calculated Property
η	[0.0001689; 0.0008639]	Pa×s	[548.84; 911.44]
η	0.0008639	Pa×s	548.84	Joback Calculated Property
η	0.0005751	Pa×s	609.27	Joback Calculated Property
η	0.0004120	Pa×s	669.71	Joback Calculated Property
η	0.0003119	Pa×s	730.14	Joback Calculated Property
η	0.0002464	Pa×s	790.57	Joback Calculated Property
η	0.0002013	Pa×s	851.01	Joback Calculated Property
η	0.0001689	Pa×s	911.44	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclopropanecarboxylic acid, trans-2-phenyl-, 4-benzyloxyphenyl ester.

Sources

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

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