Chemical Properties of 5,9-Undecadien-2-ol, 6,10-dimethyl- (CAS 53837-34-6)

InChI

InChI=1S/C13H24O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9,13-14H,5-6,8,10H2,1-4H3/b12-9+

InChI Key

LYFDNQZGOHRKNK-FMIVXFBMSA-N

Formula

C13H24O

SMILES

CC(C)=CCCC(C)=CCCC(C)O

Molecular Weight¹

196.33

CAS

53837-34-6

Other Names

• 2,6-Dimethyl-2,6-undecadien-10-ol
• 6,10-Dimethyl-5,9-undecadien-2-ol
• 6,10-Dimethylundeca-5,9-dien-2-ol
• geranylacetol [6,10-dimethyl-(E)-5,9-undecadien-2-ol]

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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.
• 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	0.6401		Relay (1.0) Calculated Property
ΔfG°	62.66	kJ/mol	Joback Calculated Property
ΔfH°gas	-353.64	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	27.77	kJ/mol	Joback Calculated Property
ΔvapH°	82.01	kJ/mol	Relay (1.0) Calculated Property
IE	8.37	eV	Relay (1.0) Calculated Property
log10WS	-3.21		Relay (1.0) Calculated Property
logPoct/wat	3.840		Crippen Calculated Property
McVol	191.300	ml/mol	McGowan Calculated Property
Pc	1971.80	kPa	Joback Calculated Property
Inp	[1459.00; 1459.00]
Inp	1459.00		NIST
Inp	1459.00		NIST
I	[1943.00; 1968.00]
I	1943.00		NIST
I	1968.00		NIST
I	1954.00		NIST
Tboil	535.17	K	Relay (1.0) Calculated Property
Tc	695.37	K	Relay (1.0) Calculated Property
Tfus	251.16	K	Relay (1.0) Calculated Property
Vc	0.689	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[490.48; 570.71]	J/mol×K	[596.66; 772.51]
Cp,gas	490.48	J/mol×K	596.66	Joback Calculated Property
Cp,gas	505.52	J/mol×K	625.97	Joback Calculated Property
Cp,gas	519.84	J/mol×K	655.28	Joback Calculated Property
Cp,gas	533.48	J/mol×K	684.58	Joback Calculated Property
Cp,gas	546.48	J/mol×K	713.89	Joback Calculated Property
Cp,gas	558.87	J/mol×K	743.20	Joback Calculated Property
Cp,gas	570.71	J/mol×K	772.51	Joback Calculated Property

Similar Compounds

Find more compounds similar to 5,9-Undecadien-2-ol, 6,10-dimethyl-.

Sources

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

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