Chemical Properties of 4-Pentenyl benzoate

InChI

InChI=1S/C12H14O2/c1-2-3-7-10-14-12(13)11-8-5-4-6-9-11/h2,4-6,8-9H,1,3,7,10H2

InChI Key

MFUGAJWSACDNNH-UHFFFAOYSA-N

Formula

C12H14O2

SMILES

C=CCCCOC(=O)c1ccccc1

Molecular Weight¹

190.24

• 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.
• I : 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°	16.49	kJ/mol	Joback Calculated Property
ΔfH°gas	-173.85	kJ/mol	Joback Calculated Property
ΔfusH°	22.38	kJ/mol	Joback Calculated Property
ΔvapH°	53.07	kJ/mol	Joback Calculated Property
log10WS	-3.24		Crippen Calculated Property
logPoct/wat	2.810		Crippen Calculated Property
McVol	159.320	ml/mol	McGowan Calculated Property
Pc	2627.15	kPa	Joback Calculated Property
Inp	[1436.00; 1463.00]
Inp	1447.00		NIST
Inp	1442.00		NIST
Inp	Outlier 1463.00		NIST
Inp	1439.00		NIST
Inp	1447.00		NIST
Inp	1452.00		NIST
Inp	1447.00		NIST
Inp	1436.00		NIST
Inp	1445.00		NIST
Inp	1443.00		NIST
Inp	1444.00		NIST
Inp	1447.00		NIST
I	[1986.00; 2042.00]
I	2012.00		NIST
I	2009.00		NIST
I	2028.00		NIST
I	2042.00		NIST
I	1986.00		NIST
I	2042.00		NIST
I	2008.00		NIST
I	2016.00		NIST
I	2016.00		NIST
I	1986.00		NIST
Tboil	573.61	K	Joback Calculated Property
Tc	783.80	K	Joback Calculated Property
Tfus	321.82	K	Joback Calculated Property
Vc	0.605	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[373.80; 448.76]	J/mol×K	[573.61; 783.80]
Cp,gas	373.80	J/mol×K	573.61	Joback Calculated Property
Cp,gas	388.35	J/mol×K	608.64	Joback Calculated Property
Cp,gas	402.04	J/mol×K	643.67	Joback Calculated Property
Cp,gas	414.90	J/mol×K	678.70	Joback Calculated Property
Cp,gas	426.96	J/mol×K	713.74	Joback Calculated Property
Cp,gas	438.23	J/mol×K	748.77	Joback Calculated Property
Cp,gas	448.76	J/mol×K	783.80	Joback Calculated Property
η	[0.0001901; 0.0021457]	Pa×s	[321.82; 573.61]
η	0.0021457	Pa×s	321.82	Joback Calculated Property
η	0.0011349	Pa×s	363.79	Joback Calculated Property
η	0.0006848	Pa×s	405.75	Joback Calculated Property
η	0.0004542	Pa×s	447.72	Joback Calculated Property
η	0.0003233	Pa×s	489.68	Joback Calculated Property
η	0.0002428	Pa×s	531.64	Joback Calculated Property
η	0.0001901	Pa×s	573.61	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-Pentenyl benzoate.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.