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

InChI

InChI=1S/C16H13ClO2/c17-12-6-8-13(9-7-12)19-16(18)15-10-14(15)11-4-2-1-3-5-11/h1-9,14-15H,10H2

InChI Key

SZRYQNUWYRWEOV-UHFFFAOYSA-N

Formula

C16H13ClO2

SMILES

O=C(Oc1ccc(Cl)cc1)C1CC1c1ccccc1

Molecular Weight¹

272.73

• 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°	106.22	kJ/mol	Joback Calculated Property
ΔfH°gas	-120.06	kJ/mol	Joback Calculated Property
ΔfusH°	31.08	kJ/mol	Joback Calculated Property
ΔvapH°	69.57	kJ/mol	Joback Calculated Property
log10WS	-4.54		Crippen Calculated Property
logPoct/wat	4.049		Crippen Calculated Property
McVol	197.600	ml/mol	McGowan Calculated Property
Pc	2497.50	kPa	Joback Calculated Property
Inp	[2190.00; 2190.00]
Inp	2190.00		NIST
Inp	2190.00		NIST
Tboil	739.61	K	Joback Calculated Property
Tc	991.44	K	Joback Calculated Property
Tfus	451.22	K	Joback Calculated Property
Vc	0.745	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[530.87; 605.01]	J/mol×K	[739.61; 991.44]
Cp,gas	530.87	J/mol×K	739.61	Joback Calculated Property
Cp,gas	546.23	J/mol×K	781.58	Joback Calculated Property
Cp,gas	560.26	J/mol×K	823.55	Joback Calculated Property
Cp,gas	573.05	J/mol×K	865.52	Joback Calculated Property
Cp,gas	584.71	J/mol×K	907.50	Joback Calculated Property
Cp,gas	595.33	J/mol×K	949.47	Joback Calculated Property
Cp,gas	605.01	J/mol×K	991.44	Joback Calculated Property
η	[0.0003911; 0.0015704]	Pa×s	[451.22; 739.61]
η	0.0015704	Pa×s	451.22	Joback Calculated Property
η	0.0011142	Pa×s	499.29	Joback Calculated Property
η	0.0008396	Pa×s	547.35	Joback Calculated Property
η	0.0006623	Pa×s	595.41	Joback Calculated Property
η	0.0005413	Pa×s	643.48	Joback Calculated Property
η	0.0004549	Pa×s	691.55	Joback Calculated Property
η	0.0003911	Pa×s	739.61	Joback Calculated Property

Similar Compounds

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

Sources

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

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