Chemical Properties of 1-Ethoxyethyl hydroxyperoxide

InChI

InChI=1S/C4H10O3/c1-3-6-4(2)7-5/h4-5H,3H2,1-2H3

InChI Key

CXWWPQGYBJCHJL-UHFFFAOYSA-N

Formula

C4H10O3

SMILES

CCOC(C)OO

Molecular Weight¹

106.12

• 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).
• 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	-414.76	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	9.06	kJ/mol	Joback Calculated Property
ΔvapH°	49.75	kJ/mol	Relay (1.0) Calculated Property
IE	10.04	eV	Relay (1.0) Calculated Property
log10WS	0.43		Relay (1.0) Calculated Property
logPoct/wat	0.858		Crippen Calculated Property
McVol	84.830	ml/mol	McGowan Calculated Property
Pc	4238.55	kPa	Joback Calculated Property
Inp	[794.00; 794.00]
Inp	794.00		NIST
Inp	794.00		NIST
Tboil	381.99	K	Relay (1.0) Calculated Property
Tc	571.14	K	Relay (1.0) Calculated Property
Tfus	259.43	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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[133.33; 281.90]	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			5.38610e+01
Coefficient B			2.97340e-01
Coefficient C			-5.40000e-06
Coefficient D			-6.39000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	133.33	J/mol×K	273.00	Calculated Property
Cp,gas	155.55	J/mol×K	353.78	Calculated Property
Cp,gas	176.81	J/mol×K	434.56	Calculated Property
Cp,gas	196.91	J/mol×K	515.33	Calculated Property
Cp,gas	215.65	J/mol×K	596.11	Calculated Property
Cp,gas	232.84	J/mol×K	676.89	Calculated Property
Cp,gas	248.25	J/mol×K	757.67	Calculated Property
Cp,gas	261.70	J/mol×K	838.44	Calculated Property
Cp,gas	272.99	J/mol×K	919.22	Calculated Property
Cp,gas	281.90	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0565209; 0.0002361]	Pa×s	[225.12; 415.88]	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			-1.48164e+01
Coefficient B			2.68867e+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.			225.12
Temperature range, max.			415.88
η	0.0565209	Pa×s	225.12	Calculated Property
η	0.0202245	Pa×s	246.32	Calculated Property
η	0.0085168	Pa×s	267.51	Calculated Property
η	0.0040721	Pa×s	288.71	Calculated Property
η	0.0021538	Pa×s	309.90	Calculated Property
η	0.0012359	Pa×s	331.10	Calculated Property
η	0.0007583	Pa×s	352.29	Calculated Property
η	0.0004917	Pa×s	373.49	Calculated Property
η	0.0003341	Pa×s	394.68	Calculated Property
η	0.0002361	Pa×s	415.88	Calculated Property

Similar Compounds

Find more compounds similar to 1-Ethoxyethyl hydroxyperoxide.

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.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.