Chemical Properties of 1,1-Dimethoxycyclopentane (CAS 931-94-2)

InChI

InChI=1S/C7H14O2/c1-8-7(9-2)5-3-4-6-7/h3-6H2,1-2H3

InChI Key

AGWFDZMDKNQQHG-UHFFFAOYSA-N

Formula

C7H14O2

SMILES

COC1(OC)CCCC1

Molecular Weight¹

130.18

CAS

931-94-2

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-397.00 ± 2.00	kJ/mol	NIST
ΔfH°liquid	-444.00 ± 1.00	kJ/mol	NIST
ΔfusH°	3.90	kJ/mol	Joback Calculated Property
ΔvapH°	[44.50; 46.07]	kJ/mol
ΔvapH°	44.50 ± 0.30	kJ/mol	NIST
ΔvapH°	46.07	kJ/mol	NIST
IE	9.25	eV	Relay (1.0) Calculated Property
logPoct/wat	1.550		Crippen Calculated Property
McVol	110.370	ml/mol	McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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	[224.74; 302.56]	J/mol×K	[419.92; 622.05]
Cp,gas	224.74	J/mol×K	419.92	Joback Calculated Property
Cp,gas	239.67	J/mol×K	453.61	Joback Calculated Property
Cp,gas	253.73	J/mol×K	487.30	Joback Calculated Property
Cp,gas	266.98	J/mol×K	520.99	Joback Calculated Property
Cp,gas	279.49	J/mol×K	554.68	Joback Calculated Property
Cp,gas	291.33	J/mol×K	588.36	Joback Calculated Property
Cp,gas	302.56	J/mol×K	622.05	Joback Calculated Property
ΔvapH	46.10	kJ/mol	325.00	NIST

Similar Compounds

Find more compounds similar to 1,1-Dimethoxycyclopentane.

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.
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