Chemical Properties of trans-7-Oxabicyclo[4.3.0]nonane (CAS 27345-70-6)

InChI

InChI=1S/C8H14O/c1-2-4-8-7(3-1)5-6-9-8/h7-8H,1-6H2/t7-,8+/m0/s1

InChI Key

DNZWAKVIOXCEHH-JGVFFNPUSA-N

Formula

C8H14O

SMILES

C1CCC2OCCC2C1

Molecular Weight¹

126.20

CAS

27345-70-6

Other Names

• Benzofuran, octahydro-, trans-

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-196.12	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	14.42	kJ/mol	Joback Calculated Property
ΔvapH°	45.36	kJ/mol	Relay (1.0) Calculated Property
IE	[9.00; 9.24]	eV
IE	9.00	eV	NIST
IE	9.24 ± 0.04	eV	NIST
logPoct/wat	1.965		Crippen Calculated Property
McVol	107.730	ml/mol	McGowan Calculated Property
Tboil	443.95	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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	[230.10; 325.93]	J/mol×K	[435.68; 654.15]
Cp,gas	230.10	J/mol×K	435.68	Joback Calculated Property
Cp,gas	248.80	J/mol×K	472.09	Joback Calculated Property
Cp,gas	266.33	J/mol×K	508.50	Joback Calculated Property
Cp,gas	282.76	J/mol×K	544.91	Joback Calculated Property
Cp,gas	298.13	J/mol×K	581.32	Joback Calculated Property
Cp,gas	312.50	J/mol×K	617.73	Joback Calculated Property
Cp,gas	325.93	J/mol×K	654.15	Joback Calculated Property
η	[0.0005316; 0.0032638]	Pa×s	[231.81; 435.68]
η	0.0032638	Pa×s	231.81	Joback Calculated Property
η	0.0019879	Pa×s	265.79	Joback Calculated Property
η	0.0013548	Pa×s	299.77	Joback Calculated Property
η	0.0009983	Pa×s	333.75	Joback Calculated Property
η	0.0007784	Pa×s	367.72	Joback Calculated Property
η	0.0006330	Pa×s	401.70	Joback Calculated Property
η	0.0005316	Pa×s	435.68	Joback Calculated Property

Similar Compounds

Find more compounds similar to trans-7-Oxabicyclo[4.3.0]nonane.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• 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.