Chemical Properties of Methylene diacetate

InChI

InChI=1S/C5H8O4/c1-4(6)8-3-9-5(2)7/h3H2,1-2H3

InChI Key

BPGDAMSIGCZZLK-UHFFFAOYSA-N

Formula

C5H8O4

SMILES

CC(=O)OCOC(C)=O

Molecular Weight¹

132.12

• ω : Acentric Factor.
• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_liquid : Liquid phase 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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	0.4794		Relay (1.0) Calculated Property
ΔcH°liquid	-2273.83 ± 0.91	kJ/mol	NIST
ΔfG°	-629.52	kJ/mol	Joback Calculated Property
ΔfH°gas	-780.66 ± 0.93	kJ/mol	NIST
ΔfH°liquid	-837.04 ± 0.91	kJ/mol	NIST
ΔfusH°	17.44	kJ/mol	Joback Calculated Property
ΔvapH°	[56.38; 56.40]	kJ/mol
ΔvapH°	56.38 ± 0.25	kJ/mol	NIST
ΔvapH°	56.40	kJ/mol	NIST
IE	9.94	eV	Relay (1.0) Calculated Property
log10WS	-0.52		Relay (1.0) Calculated Property
logPoct/wat	0.070		Crippen Calculated Property
McVol	96.190	ml/mol	McGowan Calculated Property
Pc	3509.58	kPa	Joback Calculated Property
Inp	[782.00; 785.00]
Inp	782.00		NIST
Inp	785.00		NIST
Inp	782.00		NIST
Tboil	426.43	K	Relay (1.0) Calculated Property
Tc	599.06	K	Relay (1.0) Calculated Property
Tfus	234.50	K	Relay (1.0) Calculated Property
Vc	0.379	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[191.91; 238.24]	J/mol×K	[430.44; 613.38]
Cp,gas	191.91	J/mol×K	430.44	Joback Calculated Property
Cp,gas	200.37	J/mol×K	460.93	Joback Calculated Property
Cp,gas	208.54	J/mol×K	491.42	Joback Calculated Property
Cp,gas	216.43	J/mol×K	521.91	Joback Calculated Property
Cp,gas	224.02	J/mol×K	552.40	Joback Calculated Property
Cp,gas	231.29	J/mol×K	582.89	Joback Calculated Property
Cp,gas	238.24	J/mol×K	613.38	Joback Calculated Property
η	[0.0002583; 0.0059498]	Pa×s	[230.77; 430.44]
η	0.0059498	Pa×s	230.77	Joback Calculated Property
η	0.0025371	Pa×s	264.05	Joback Calculated Property
η	0.0013093	Pa×s	297.33	Joback Calculated Property
η	0.0007719	Pa×s	330.60	Joback Calculated Property
η	0.0005013	Pa×s	363.88	Joback Calculated Property
η	0.0003499	Pa×s	397.16	Joback Calculated Property
η	0.0002583	Pa×s	430.44	Joback Calculated Property
ΔvapH	50.60	kJ/mol	388.50	NIST

Similar Compounds

Find more compounds similar to Methylene diacetate.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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