Chemical Properties of 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2,2,2-trifluoroacetate

InChI

InChI=1S/C29H55F3O15/c1-34-2-3-35-4-5-36-6-7-37-8-9-38-10-11-39-12-13-40-14-15-41-16-17-42-18-19-43-20-21-44-22-23-45-24-25-46-26-27-47-28(33)29(30,31)32/h2-27H2,1H3

InChI Key

RCVSFCCTQRLGIT-UHFFFAOYSA-N

Formula

C29H55F3O15

SMILES

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC(=O)C(F)(F)F

Molecular Weight¹

700.73

Other Names

• Tridecaethylene glycol monomethyl ether, trifluoroacetate
• 3,6,9,12,15,18,21,24,27,30,33,36,39-Tridecaoxatetracont-1-yl trifluoroacetate

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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.
• 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
ΔfH°gas	-3114.31	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	92.51	kJ/mol	Joback Calculated Property
ΔvapH°	137.49	kJ/mol	Relay (1.0) Calculated Property
IE	10.31	eV	Relay (1.0) Calculated Property
log10WS	-0.58		Relay (1.0) Calculated Property
logPoct/wat	0.938		Crippen Calculated Property
McVol	508.530	ml/mol	McGowan Calculated Property
Pc	532.38	kPa	Joback Calculated Property
Inp	[3802.30; 3802.30]
Inp	3802.30		NIST
Inp	3802.30		NIST
Tboil	806.24	K	Relay (1.0) Calculated Property
Tc	879.31	K	Relay (1.0) Calculated Property
Tfus	190.02	K	Relay (1.0) Calculated Property

Cheméo can also estimate 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1403.07; 1838.31]	J/mol×K	[1207.38; 1704.77]
Cp,gas	1838.31	J/mol×K	1207.38	Joback Calculated Property
Cp,gas	1824.01	J/mol×K	1290.28	Joback Calculated Property
Cp,gas	1788.00	J/mol×K	1373.18	Joback Calculated Property
Cp,gas	1729.08	J/mol×K	1456.08	Joback Calculated Property
Cp,gas	1646.08	J/mol×K	1538.97	Joback Calculated Property
Cp,gas	1537.80	J/mol×K	1621.87	Joback Calculated Property
Cp,gas	1403.07	J/mol×K	1704.77	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2,2,2-trifluoroacetate.

Sources

• Cheméo Relay (1.0)
• 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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