Chemical Properties of 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2,2,3,3,4,4,4-heptafluorobutanoate

InChI

InChI=1S/C27H47F7O13/c1-36-2-3-37-4-5-38-6-7-39-8-9-40-10-11-41-12-13-42-14-15-43-16-17-44-18-19-45-20-21-46-22-23-47-24(35)25(28,29)26(30,31)27(32,33)34/h2-23H2,1H3

InChI Key

NOLNPPXAZCUTMD-UHFFFAOYSA-N

Formula

C27H47F7O13

SMILES

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC(=O)C(F)(F)C(F)(F)C(F)(F)F

Molecular Weight¹

712.64

Other Names

• Undecaethylene glycol monomethyl ether, heptafluorobutyrate
• 3,6,9,12,15,18,21,24,27,30,33-Undecaoxatetratriacont-1-yl heptafluorobutyrate

• ω : Acentric Factor.
• 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).
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	1.5824		Relay (... Calculated Property
ΔfG°	-2567.61	kJ/mol	Joback Calculated Property
ΔfH°gas	-3634.96	kJ/mol	Relay (... Calculated Property
ΔfusH°	80.86	kJ/mol	Joback Calculated Property
ΔvapH°	127.72	kJ/mol	Relay (... Calculated Property
IE	10.34	eV	Relay (... Calculated Property
log10WS	-2.82		Relay (... Calculated Property
logPoct/wat	2.175		Crippen Calculated Property
McVol	475.690	ml/mol	McGowan Calculated Property
Pc	564.47	kPa	Joback Calculated Property
Inp	[3276.30; 3276.30]
Inp	3276.30		NIST
Inp	3276.30		NIST
Tboil	760.67	K	Relay (... Calculated Property
Tc	817.61	K	Relay (... Calculated Property
Tfus	185.90	K	Relay (... Calculated Property
Vc	1.780	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1632.13; 1732.84]	J/mol×K	[1125.27; 1529.53]
Cp,gas	1722.04	J/mol×K	1125.27	Joback Calculated Property
Cp,gas	1732.38	J/mol×K	1192.65	Joback Calculated Property
Cp,gas	1732.84	J/mol×K	1260.02	Joback Calculated Property
Cp,gas	1723.23	J/mol×K	1327.40	Joback Calculated Property
Cp,gas	1703.36	J/mol×K	1394.78	Joback Calculated Property
Cp,gas	1673.06	J/mol×K	1462.16	Joback Calculated Property
Cp,gas	1632.13	J/mol×K	1529.53	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-Methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2,2,3,3,4,4,4-heptafluorobutanoate.

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.