Chemical Properties of 11,13-Dimethyl-12-tetradecen-1-ol acetate

InChI

InChI=1S/C18H34O2/c1-16(2)15-17(3)13-11-9-7-5-6-8-10-12-14-20-18(4)19/h15,17H,5-14H2,1-4H3

InChI Key

MNUWBCKALSZWEW-UHFFFAOYSA-N

Formula

C18H34O2

SMILES

CC(=O)OCCCCCCCCCCC(C)C=C(C)C

Molecular Weight¹

282.46

• 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).
• 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_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
ΔfG°	-64.01	kJ/mol	Joback Calculated Property
ΔfH°gas	-557.50	kJ/mol	Joback Calculated Property
ΔfusH°	40.53	kJ/mol	Joback Calculated Property
ΔvapH°	64.47	kJ/mol	Joback Calculated Property
log10WS	-5.83		Crippen Calculated Property
logPoct/wat	5.663		Crippen Calculated Property
McVol	267.620	ml/mol	McGowan Calculated Property
Pc	1244.21	kPa	Joback Calculated Property
Inp	[1955.10; 1955.10]
Inp	1955.10		NIST
Inp	1955.10		NIST
Tboil	691.13	K	Joback Calculated Property
Tc	867.34	K	Joback Calculated Property
Tfus	330.74	K	Joback Calculated Property
Vc	1.042	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[768.10; 867.86]	J/mol×K	[691.13; 867.34]
Cp,gas	768.10	J/mol×K	691.13	Joback Calculated Property
Cp,gas	786.83	J/mol×K	720.50	Joback Calculated Property
Cp,gas	804.68	J/mol×K	749.87	Joback Calculated Property
Cp,gas	821.68	J/mol×K	779.23	Joback Calculated Property
Cp,gas	837.85	J/mol×K	808.60	Joback Calculated Property
Cp,gas	853.24	J/mol×K	837.97	Joback Calculated Property
Cp,gas	867.86	J/mol×K	867.34	Joback Calculated Property

Similar Compounds

Find more compounds similar to 11,13-Dimethyl-12-tetradecen-1-ol acetate.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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