Chemical Properties of E-14-Hexadecenal (CAS 330207-53-9)

InChI

InChI=1S/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-3,16H,4-15H2,1H3/b3-2+

InChI Key

XVOLIFYNNVCOPB-NSCUHMNNSA-N

Formula

C16H30O

SMILES

CC=CCCCCCCCCCCCCC=O

Molecular Weight¹

238.41

CAS

330207-53-9

Other Names

• (14E)-14-Hexadecenal
• 14-Hexadecenal, (E)-

• 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 : 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	0.7415		Relay (1.0) Calculated Property
ΔfG°	64.54	kJ/mol	Joback Calculated Property
ΔfH°gas	-397.61	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	39.69	kJ/mol	Joback Calculated Property
ΔvapH°	91.63	kJ/mol	Relay (1.0) Calculated Property
IE	9.14	eV	Relay (1.0) Calculated Property
log10WS	-5.85		Relay (1.0) Calculated Property
logPoct/wat	5.443		Crippen Calculated Property
McVol	233.570	ml/mol	McGowan Calculated Property
Pc	1447.94	kPa	Joback Calculated Property
I	[2189.00; 2189.00]
I	2189.00		NIST
I	2189.00		NIST
Tboil	573.28	K	Relay (1.0) Calculated Property
Tc	764.91	K	Relay (1.0) Calculated Property
Tfus	304.96	K	Relay (1.0) Calculated Property
Vc	0.882	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[624.52; 718.34]	J/mol×K	[618.50; 787.74]
Cp,gas	624.52	J/mol×K	618.50	Joback Calculated Property
Cp,gas	642.00	J/mol×K	646.71	Joback Calculated Property
Cp,gas	658.70	J/mol×K	674.91	Joback Calculated Property
Cp,gas	674.65	J/mol×K	703.12	Joback Calculated Property
Cp,gas	689.89	J/mol×K	731.33	Joback Calculated Property
Cp,gas	704.44	J/mol×K	759.53	Joback Calculated Property
Cp,gas	718.34	J/mol×K	787.74	Joback Calculated Property
η	[0.0001476; 0.0038359]	Pa×s	[307.00; 618.50]
η	0.0038359	Pa×s	307.00	Joback Calculated Property
η	0.0015049	Pa×s	358.92	Joback Calculated Property
η	0.0007479	Pa×s	410.83	Joback Calculated Property
η	0.0004348	Pa×s	462.75	Joback Calculated Property
η	0.0002820	Pa×s	514.67	Joback Calculated Property
η	0.0001980	Pa×s	566.58	Joback Calculated Property
η	0.0001476	Pa×s	618.50	Joback Calculated Property

Similar Compounds

Find more compounds similar to E-14-Hexadecenal.

Sources

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

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