Chemical Properties of 9-Tetradecen-1-ol, acetate, (Z)- (CAS 16725-53-4)

InChI

InChI=1S/C16H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16(2)17/h6-7H,3-5,8-15H2,1-2H3/b7-6-

InChI Key

XXPBOEBNDHAAQH-SREVYHEPSA-N

Formula

C16H30O2

SMILES

CCCCC=CCCCCCCCCOC(C)=O

Molecular Weight¹

254.41

CAS

16725-53-4

Other Names

• (9Z)-9-Tetradecenyl acetate
• (Z)-9-Tetradecen-1-ol acetate
• (Z)-9-tetradecyl acetate
• (Z)-tetradec-9-enyl acetate
• 9-Tetradecen-1-ol, acetate, (9Z)-
• Z-9-Tetradecen-1-yl acetate
• Z-9-Tetradecenyl acetate
• acetic acid tetradec-9-enyl ester, cis
• cis-9-Tetradecenyl acetate

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• 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).
• P_vap : Vapor 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
ω	0.7430		Relay (1.0) Calculated Property
ΔfH°gas	-634.25	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	41.77	kJ/mol	Joback Calculated Property
ΔvapH°	89.10	kJ/mol	NIST
IE	8.82	eV	Relay (1.0) Calculated Property
log10WS	-5.15		Relay (1.0) Calculated Property
logPoct/wat	5.027		Crippen Calculated Property
McVol	239.440	ml/mol	McGowan Calculated Property
Pc	1374.80	kPa	Joback Calculated Property
Inp	[1799.00; 1801.00]
Inp	1801.00		NIST
Inp	1799.00		NIST
Inp	1799.00		NIST
Inp	1801.00		NIST
I	[2120.00; 2142.00]
I	2120.00		NIST
I	2142.00		NIST
I	2142.00		NIST
I	2120.00		NIST
Tboil	564.39	K	Relay (1.0) Calculated Property
Tc	734.84	K	Relay (1.0) Calculated Property
Tfus	255.78	K	Relay (1.0) Calculated Property
Vc	0.907	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[347.24; 822.31]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-4.29000e-01
Coefficient B			1.48904e+00
Coefficient C			-8.35800e-04
Coefficient D			1.69500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	347.24	J/mol×K	273.00	Calculated Property
Cp,gas	429.26	J/mol×K	353.78	Calculated Property
Cp,gas	502.72	J/mol×K	434.56	Calculated Property
Cp,gas	568.16	J/mol×K	515.33	Calculated Property
Cp,gas	626.11	J/mol×K	596.11	Calculated Property
Cp,gas	677.11	J/mol×K	676.89	Calculated Property
Cp,gas	721.69	J/mol×K	757.67	Calculated Property
Cp,gas	760.40	J/mol×K	838.44	Calculated Property
Cp,gas	793.76	J/mol×K	919.22	Calculated Property
Cp,gas	822.31	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0035634; 0.0001460]	Pa×s	[307.33; 558.59]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.27400e+01
Coefficient B			2.18296e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			307.33
Temperature range, max.			558.59
η	0.0035634	Pa×s	307.33	Calculated Property
η	0.0019723	Pa×s	335.25	Calculated Property
η	0.0011956	Pa×s	363.17	Calculated Property
η	0.0007784	Pa×s	391.08	Calculated Property
η	0.0005367	Pa×s	419.00	Calculated Property
η	0.0003876	Pa×s	446.92	Calculated Property
η	0.0002908	Pa×s	474.84	Calculated Property
η	0.0002253	Pa×s	502.76	Calculated Property
η	0.0001793	Pa×s	530.68	Calculated Property
η	0.0001460	Pa×s	558.59	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[444.92; 613.21]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.55271e+01
Coefficient B			-5.21513e+03
Coefficient C			-1.02710e+02
Temperature range, min.			444.92
Temperature range, max.			613.21
Pvap	1.33	kPa	444.92	Calculated Property
Pvap	2.94	kPa	463.62	Calculated Property
Pvap	5.98	kPa	482.32	Calculated Property
Pvap	11.40	kPa	501.02	Calculated Property
Pvap	20.51	kPa	519.72	Calculated Property
Pvap	35.08	kPa	538.41	Calculated Property
Pvap	57.41	kPa	557.11	Calculated Property
Pvap	90.37	kPa	575.81	Calculated Property
Pvap	137.42	kPa	594.51	Calculated Property
Pvap	202.64	kPa	613.21	Calculated Property

Similar Compounds

Find more compounds similar to 9-Tetradecen-1-ol, acetate, (Z)-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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