Chemical Properties of trans-2,3-epoxyundecanal

InChI

InChI=1S/C11H20O2/c1-2-3-4-5-6-7-8-10-11(9-12)13-10/h9-11H,2-8H2,1H3/t10-,11-/m1/s1

InChI Key

LZLASHVOFOBXCU-QWRGUYRKSA-N

Formula

C11H20O2

SMILES

CCCCCCCC[C@H]1O[C@@H]1C=O

Molecular Weight¹

184.28

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[239.93; 583.53]	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			-2.26930e+01
Coefficient B			1.14472e+00
Coefficient C			-7.18500e-04
Coefficient D			1.80000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	239.93	J/mol×K	273.00	Calculated Property
Cp,gas	300.33	J/mol×K	353.78	Calculated Property
Cp,gas	353.84	J/mol×K	434.56	Calculated Property
Cp,gas	401.04	J/mol×K	515.33	Calculated Property
Cp,gas	442.50	J/mol×K	596.11	Calculated Property
Cp,gas	478.78	J/mol×K	676.89	Calculated Property
Cp,gas	510.45	J/mol×K	757.67	Calculated Property
Cp,gas	538.09	J/mol×K	838.44	Calculated Property
Cp,gas	562.26	J/mol×K	919.22	Calculated Property
Cp,gas	583.53	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0028064; 0.0007177]	Pa×s	[296.00; 495.61]	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			-9.26155e+00
Coefficient B			1.00217e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			296.00
Temperature range, max.			495.61
η	0.0028064	Pa×s	296.00	Calculated Property
η	0.0022165	Pa×s	318.18	Calculated Property
η	0.0018052	Pa×s	340.36	Calculated Property
η	0.0015076	Pa×s	362.54	Calculated Property
η	0.0012855	Pa×s	384.71	Calculated Property
η	0.0011154	Pa×s	406.89	Calculated Property
η	0.0009820	Pa×s	429.07	Calculated Property
η	0.0008755	Pa×s	451.25	Calculated Property
η	0.0007890	Pa×s	473.43	Calculated Property
η	0.0007177	Pa×s	495.61	Calculated Property

Similar Compounds

Find more compounds similar to trans-2,3-epoxyundecanal.

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

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