Chemical Properties of Cyclopropanecarboxylic acid, trans-2-phenyl-, pentadec-5-yl ester

InChI

InChI=1S/C25H40O2/c1-3-5-7-8-9-10-11-15-19-22(18-6-4-2)27-25(26)24-20-23(24)21-16-13-12-14-17-21/h12-14,16-17,22-24H,3-11,15,18-20H2,1-2H3

InChI Key

VBKFPQJGXNLFGK-UHFFFAOYSA-N

Formula

C25H40O2

SMILES

CCCCCCCCCCC(CCCC)OC(=O)C1CC1c1ccccc1

Molecular Weight¹

372.58

• 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°	88.71	kJ/mol	Joback Calculated Property
ΔfH°gas	-520.42	kJ/mol	Joback Calculated Property
ΔfusH°	53.02	kJ/mol	Joback Calculated Property
ΔvapH°	81.89	kJ/mol	Joback Calculated Property
log10WS	-7.98		Crippen Calculated Property
logPoct/wat	7.423		Crippen Calculated Property
McVol	335.930	ml/mol	McGowan Calculated Property
Pc	1016.83	kPa	Joback Calculated Property
Inp	[2655.00; 2655.00]
Inp	2655.00		NIST
Inp	2655.00		NIST
Tboil	876.00	K	Joback Calculated Property
Tc	1078.33	K	Joback Calculated Property
Tfus	468.79	K	Joback Calculated Property
Vc	1.302	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1117.57; 1220.28]	J/mol×K	[876.00; 1078.33]
Cp,gas	1117.57	J/mol×K	876.00	Joback Calculated Property
Cp,gas	1137.50	J/mol×K	909.72	Joback Calculated Property
Cp,gas	1156.20	J/mol×K	943.44	Joback Calculated Property
Cp,gas	1173.76	J/mol×K	977.16	Joback Calculated Property
Cp,gas	1190.24	J/mol×K	1010.88	Joback Calculated Property
Cp,gas	1205.72	J/mol×K	1044.60	Joback Calculated Property
Cp,gas	1220.28	J/mol×K	1078.33	Joback Calculated Property
η	[0.0001393; 0.0014187]	Pa×s	[468.79; 876.00]
η	0.0014187	Pa×s	468.79	Joback Calculated Property
η	0.0007545	Pa×s	536.66	Joback Calculated Property
η	0.0004624	Pa×s	604.53	Joback Calculated Property
η	0.0003129	Pa×s	672.39	Joback Calculated Property
η	0.0002274	Pa×s	740.26	Joback Calculated Property
η	0.0001744	Pa×s	808.13	Joback Calculated Property
η	0.0001393	Pa×s	876.00	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclopropanecarboxylic acid, trans-2-phenyl-, pentadec-5-yl ester.

Sources

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

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