Chemical Properties of Butyric acid, 2-phenyl-, oct-3-en-2-yl ester

InChI

InChI=1S/C18H26O2/c1-4-6-7-9-12-15(3)20-18(19)17(5-2)16-13-10-8-11-14-16/h8-15,17H,4-7H2,1-3H3/b12-9+

InChI Key

PRQHFUJYDIPSFX-FMIVXFBMSA-N

Formula

C18H26O2

SMILES

CCCCC=CC(C)OC(=O)C(CC)c1ccccc1

Molecular Weight¹

274.40

• 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°	54.51	kJ/mol	Joback Calculated Property
ΔfH°gas	-316.46	kJ/mol	Joback Calculated Property
ΔfusH°	32.36	kJ/mol	Joback Calculated Property
ΔvapH°	66.28	kJ/mol	Joback Calculated Property
log10WS	-5.25		Crippen Calculated Property
logPoct/wat	4.858		Crippen Calculated Property
McVol	243.860	ml/mol	McGowan Calculated Property
Pc	1598.72	kPa	Joback Calculated Property
Inp	[1806.00; 1806.00]
Inp	1806.00		NIST
Inp	1806.00		NIST
Tboil	717.49	K	Joback Calculated Property
Tc	921.71	K	Joback Calculated Property
Tfus	356.12	K	Joback Calculated Property
Vc	0.927	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[688.78; 780.81]	J/mol×K	[717.49; 921.71]
Cp,gas	688.78	J/mol×K	717.49	Joback Calculated Property
Cp,gas	706.68	J/mol×K	751.53	Joback Calculated Property
Cp,gas	723.49	J/mol×K	785.56	Joback Calculated Property
Cp,gas	739.26	J/mol×K	819.60	Joback Calculated Property
Cp,gas	754.03	J/mol×K	853.64	Joback Calculated Property
Cp,gas	767.86	J/mol×K	887.68	Joback Calculated Property
Cp,gas	780.81	J/mol×K	921.71	Joback Calculated Property
η	[0.0000707; 0.0022889]	Pa×s	[356.12; 717.49]
η	0.0022889	Pa×s	356.12	Joback Calculated Property
η	0.0008430	Pa×s	416.35	Joback Calculated Property
η	0.0003997	Pa×s	476.58	Joback Calculated Property
η	0.0002240	Pa×s	536.81	Joback Calculated Property
η	0.0001411	Pa×s	597.03	Joback Calculated Property
η	0.0000968	Pa×s	657.26	Joback Calculated Property
η	0.0000707	Pa×s	717.49	Joback Calculated Property

Similar Compounds

Find more compounds similar to Butyric acid, 2-phenyl-, oct-3-en-2-yl ester.

Sources

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

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