Chemical Properties of Oxirane, tetradecyl- (CAS 7320-37-8)

InChI

InChI=1S/C16H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-15-17-16/h16H,2-15H2,1H3

InChI Key

DSZTYVZOIUIIGA-UHFFFAOYSA-N

Formula

C16H32O

SMILES

CCCCCCCCCCCCCCC1CO1

Molecular Weight¹

240.42

CAS

7320-37-8

Other Names

• Hexadecane, 1,2-epoxy-
• Hexadecylene oxide
• 1,2-Epoxyhexadecane
• 1,2-Hexadecane oxide
• 1,2-Hexadecene epoxide
• Hexadecene epoxide
• NCI-C55538
• 2-Tetradecyloxirane
• Oxirane, 2-tetradecyl-
• Tetradecyloxirane

• ω : Acentric Factor.
• 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).
• 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (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	0.7515		Relay (1.0) Calculated Property
ΔfG°	58.47	kJ/mol	Joback Calculated Property
ΔfH°gas	-395.83	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	43.31	kJ/mol	Joback Calculated Property
ΔvapH°	92.79	kJ/mol	Relay (1.0) Calculated Property
IE	9.89	eV	Relay (1.0) Calculated Property
log10WS	-6.41		Relay (1.0) Calculated Property
logPoct/wat	5.476		Crippen Calculated Property
McVol	231.310	ml/mol	McGowan Calculated Property
Pc	1442.44	kPa	Joback Calculated Property
Inp	[1676.00; 1708.00]
Inp	1708.00		NIST
Inp	1708.00		NIST
Inp	1676.00		NIST
Inp	1708.00		NIST
Inp	1676.00		NIST
Tboil	567.87	K	Relay (1.0) Calculated Property
Tc	748.22	K	Relay (1.0) Calculated Property
Tfus	296.03	K	Relay (1.0) Calculated Property
Vc	0.934	m3/kmol	Relay (1.0) Calculated Property

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[338.82; 844.04]	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			-4.45770e+01
Coefficient B			1.67172e+00
Coefficient C			-1.05290e-03
Coefficient D			2.69800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	338.82	J/mol×K	273.00	Calculated Property
Cp,gas	427.01	J/mol×K	353.78	Calculated Property
Cp,gas	505.19	J/mol×K	434.56	Calculated Property
Cp,gas	574.22	J/mol×K	515.33	Calculated Property
Cp,gas	634.96	J/mol×K	596.11	Calculated Property
Cp,gas	688.25	J/mol×K	676.89	Calculated Property
Cp,gas	734.95	J/mol×K	757.67	Calculated Property
Cp,gas	775.91	J/mol×K	838.44	Calculated Property
Cp,gas	811.99	J/mol×K	919.22	Calculated Property
Cp,gas	844.04	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0034535; 0.0004605]	Pa×s	[314.59; 537.59]	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			-1.05256e+01
Coefficient B			1.52803e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			314.59
Temperature range, max.			537.59
η	0.0034535	Pa×s	314.59	Calculated Property
η	0.0024224	Pa×s	339.37	Calculated Property
η	0.0017832	Pa×s	364.15	Calculated Property
η	0.0013649	Pa×s	388.92	Calculated Property
η	0.0010787	Pa×s	413.70	Calculated Property
η	0.0008755	Pa×s	438.48	Calculated Property
η	0.0007266	Pa×s	463.26	Calculated Property
η	0.0006146	Pa×s	488.04	Calculated Property
η	0.0005283	Pa×s	512.81	Calculated Property
η	0.0004605	Pa×s	537.59	Calculated Property

Similar Compounds

Find more compounds similar to Oxirane, tetradecyl-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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