Chemical Properties of 2,3-Dioxabicyclo[2.2.2]octane (CAS 280-53-5)

InChI

InChI=1S/C6H10O2/c1-2-6-4-3-5(1)7-8-6/h5-6H,1-4H2

InChI Key

BFPOIBUGVNVNKU-UHFFFAOYSA-N

Formula

C6H10O2

SMILES

C1CC2CCC1OO2

Molecular Weight¹

114.14

CAS

280-53-5

• 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_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).
• 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
ΔfG°	-75.30	kJ/mol	Joback Calculated Property
ΔfH°gas	-297.89	kJ/mol	Joback Calculated Property
ΔfusH°	19.32	kJ/mol	Joback Calculated Property
ΔvapH°	38.14	kJ/mol	Joback Calculated Property
IE	[8.82; 8.83]	eV
IE	8.83	eV	NIST
IE	8.82	eV	NIST
log10WS	-1.51		Crippen Calculated Property
logPoct/wat	1.259		Crippen Calculated Property
McVol	85.420	ml/mol	McGowan Calculated Property
Pc	4432.62	kPa	Joback Calculated Property
Tboil	412.60	K	Joback Calculated Property
Tc	627.05	K	Joback Calculated Property
Tfus	239.36	K	Joback Calculated Property
Vc	0.311	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[179.02; 254.64]	J/mol×K	[412.60; 627.05]
Cp,gas	179.02	J/mol×K	412.60	Joback Calculated Property
Cp,gas	193.88	J/mol×K	448.34	Joback Calculated Property
Cp,gas	207.76	J/mol×K	484.08	Joback Calculated Property
Cp,gas	220.73	J/mol×K	519.82	Joback Calculated Property
Cp,gas	232.84	J/mol×K	555.57	Joback Calculated Property
Cp,gas	244.12	J/mol×K	591.31	Joback Calculated Property
Cp,gas	254.64	J/mol×K	627.05	Joback Calculated Property
η	[0.0006719; 0.0023936]	Pa×s	[239.36; 412.60]
η	0.0023936	Pa×s	239.36	Joback Calculated Property
η	0.0017282	Pa×s	268.23	Joback Calculated Property
η	0.0013294	Pa×s	297.11	Joback Calculated Property
η	0.0010712	Pa×s	325.98	Joback Calculated Property
η	0.0008941	Pa×s	354.85	Joback Calculated Property
η	0.0007668	Pa×s	383.73	Joback Calculated Property
η	0.0006719	Pa×s	412.60	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,3-Dioxabicyclo[2.2.2]octane.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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