Chemical Properties of Cyclododecyl methyl ether (CAS 2986-54-1)

InChI

InChI=1S/C13H26O/c1-14-13-11-9-7-5-3-2-4-6-8-10-12-13/h13H,2-12H2,1H3

InChI Key

WDSOYUINLRIGNV-UHFFFAOYSA-N

Formula

C13H26O

SMILES

COC1CCCCCCCCCCC1

Molecular Weight¹

198.34

CAS

2986-54-1

Other Names

• Cyclododecane, methoxy-
• methoxycyclododecane

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[229.19; 704.26]	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			-7.97600e+01
Coefficient B			1.24012e+00
Coefficient C			-3.75000e-04
Coefficient D			-8.11000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	229.19	J/mol×K	273.00	Calculated Property
Cp,gas	308.44	J/mol×K	353.78	Calculated Property
Cp,gas	381.67	J/mol×K	434.56	Calculated Property
Cp,gas	448.63	J/mol×K	515.33	Calculated Property
Cp,gas	509.05	J/mol×K	596.11	Calculated Property
Cp,gas	562.69	J/mol×K	676.89	Calculated Property
Cp,gas	609.29	J/mol×K	757.67	Calculated Property
Cp,gas	648.59	J/mol×K	838.44	Calculated Property
Cp,gas	680.33	J/mol×K	919.22	Calculated Property
Cp,gas	704.26	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0479580; 0.0000428]	Pa×s	[244.76; 558.01]	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			-1.55440e+01
Coefficient B			3.06110e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			244.76
Temperature range, max.			558.01
η	0.0479580	Pa×s	244.76	Calculated Property
η	0.0101074	Pa×s	279.57	Calculated Property
η	0.0030071	Pa×s	314.37	Calculated Property
η	0.0011393	Pa×s	349.18	Calculated Property
η	0.0005147	Pa×s	383.98	Calculated Property
η	0.0002653	Pa×s	418.79	Calculated Property
η	0.0001514	Pa×s	453.59	Calculated Property
η	0.0000936	Pa×s	488.40	Calculated Property
η	0.0000617	Pa×s	523.21	Calculated Property
η	0.0000428	Pa×s	558.01	Calculated Property

Similar Compounds

Find more compounds similar to Cyclododecyl methyl ether.

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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