Chemical Properties of (4Z,7Z)-2-Acetoxy-4,7-tridecadiene

InChI

InChI=1S/C15H26O2/c1-4-5-6-7-8-9-10-11-12-13-14(2)17-15(3)16/h8-9,11-12,14H,4-7,10,13H2,1-3H3/b9-8+,12-11?

InChI Key

WBTCMXVCGSBLBM-MURFETPASA-N

Formula

C15H26O2

SMILES

CCCCC/C=C\C/C=C\CC(C)OC(C)=O

Molecular Weight¹

238.37

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	35.86	kJ/mol	Joback Calculated Property
ΔvapH°	83.13	kJ/mol	Relay (1.0) Calculated Property
IE	8.89	eV	Relay (1.0) Calculated Property
logPoct/wat	4.411		Crippen Calculated Property
McVol	221.050	ml/mol	McGowan Calculated Property
Inp	[1605.00; 1605.00]
Inp	1605.00		NIST
Inp	1605.00		NIST
Tboil	516.92	K	Relay (1.0) Calculated Property
Tc	703.09	K	Relay (1.0) Calculated Property
Tfus	212.88	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[573.43; 664.51]	J/mol×K	[608.90; 788.31]
Cp,gas	573.43	J/mol×K	608.90	Joback Calculated Property
Cp,gas	590.63	J/mol×K	638.80	Joback Calculated Property
Cp,gas	606.98	J/mol×K	668.70	Joback Calculated Property
Cp,gas	622.51	J/mol×K	698.61	Joback Calculated Property
Cp,gas	637.25	J/mol×K	728.51	Joback Calculated Property
Cp,gas	651.24	J/mol×K	758.41	Joback Calculated Property
Cp,gas	664.51	J/mol×K	788.31	Joback Calculated Property
η	[0.0000850; 0.0054805]	Pa×s	[275.98; 608.90]
η	0.0054805	Pa×s	275.98	Joback Calculated Property
η	0.0015306	Pa×s	331.47	Joback Calculated Property
η	0.0006163	Pa×s	386.95	Joback Calculated Property
η	0.0003118	Pa×s	442.44	Joback Calculated Property
η	0.0001836	Pa×s	497.93	Joback Calculated Property
η	0.0001202	Pa×s	553.41	Joback Calculated Property
η	0.0000850	Pa×s	608.90	Joback Calculated Property

Similar Compounds

Find more compounds similar to (4Z,7Z)-2-Acetoxy-4,7-tridecadiene.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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