Chemical Properties of 9-Dodecenol, trans (CAS 35237-62-8)

InChI

InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h3-4,13H,2,5-12H2,1H3/b4-3+

InChI Key

GJNNIRNIXNLOJP-ONEGZZNKSA-N

Formula

C12H24O

SMILES

CCC=CCCCCCCCCO

Molecular Weight¹

184.32

CAS

35237-62-8

Other Names

• (9E)-9-Dodecen-1-ol
• (E)-9-Dodecenyl alcohol
• (E)9-Dodecen-1-ol
• 9-Dodecen-1-ol
• 9-Dodecen-1-ol, (9E)-
• 9-Dodecen-1-ol, (E)-
• 9-Dodecenol, E
• trans-9-Dodecen-1-ol

• 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).
• 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	0.7704		Relay (1.0) Calculated Property
ΔfG°	-6.44	kJ/mol	Joback Calculated Property
ΔfH°gas	-367.58	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	31.13	kJ/mol	Joback Calculated Property
ΔvapH°	91.70	kJ/mol	NIST
IE	9.03	eV	Relay (1.0) Calculated Property
log10WS	-4.06		Relay (1.0) Calculated Property
logPoct/wat	3.676		Crippen Calculated Property
McVol	181.510	ml/mol	McGowan Calculated Property
Pc	2018.13	kPa	Joback Calculated Property
Inp	[1428.00; 1470.00]
Inp	1428.00		NIST
Inp	1470.00		NIST
Inp	1469.00		NIST
Inp	1470.00		NIST
I	[1994.00; 2043.00]
I	2013.00		NIST
I	2043.00		NIST
I	1994.00		NIST
I	2013.00		NIST
Tboil	538.50	K	Relay (1.0) Calculated Property
Tc	724.06	K	Relay (1.0) Calculated Property
Tfus	271.51	K	Relay (1.0) Calculated Property
Vc	0.676	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[258.55; 626.51]	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			-1.69110e+01
Coefficient B			1.19782e+00
Coefficient C			-7.43200e-04
Coefficient D			1.88800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	258.55	J/mol×K	273.00	Calculated Property
Cp,gas	322.19	J/mol×K	353.78	Calculated Property
Cp,gas	378.76	J/mol×K	434.56	Calculated Property
Cp,gas	428.83	J/mol×K	515.33	Calculated Property
Cp,gas	473.02	J/mol×K	596.11	Calculated Property
Cp,gas	511.92	J/mol×K	676.89	Calculated Property
Cp,gas	546.11	J/mol×K	757.67	Calculated Property
Cp,gas	576.22	J/mol×K	838.44	Calculated Property
Cp,gas	602.81	J/mol×K	919.22	Calculated Property
Cp,gas	626.51	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0209597; 0.0001322]	Pa×s	[280.74; 513.67]	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			-1.50363e+01
Coefficient B			3.13619e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			280.74
Temperature range, max.			513.67
η	0.0209597	Pa×s	280.74	Calculated Property
η	0.0081635	Pa×s	306.62	Calculated Property
η	0.0036823	Pa×s	332.50	Calculated Property
η	0.0018634	Pa×s	358.38	Calculated Property
η	0.0010335	Pa×s	384.26	Calculated Property
η	0.0006175	Pa×s	410.15	Calculated Property
η	0.0003922	Pa×s	436.03	Calculated Property
η	0.0002621	Pa×s	461.91	Calculated Property
η	0.0001828	Pa×s	487.79	Calculated Property
η	0.0001322	Pa×s	513.67	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[414.52; 591.59]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.44974e+01
Coefficient B			-4.60063e+03
Coefficient C			-9.07560e+01
Temperature range, min.			414.52
Temperature range, max.			591.59
Pvap	1.33	kPa	414.52	Calculated Property
Pvap	3.01	kPa	434.19	Calculated Property
Pvap	6.22	kPa	453.87	Calculated Property
Pvap	11.93	kPa	473.54	Calculated Property
Pvap	21.46	kPa	493.22	Calculated Property
Pvap	36.56	kPa	512.89	Calculated Property
Pvap	59.40	kPa	532.57	Calculated Property
Pvap	92.59	kPa	552.24	Calculated Property
Pvap	139.19	kPa	571.92	Calculated Property
Pvap	202.65	kPa	591.59	Calculated Property

Similar Compounds

Find more compounds similar to 9-Dodecenol, trans.

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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