Chemical Properties of 1,3-Dioxolane, 2-isobutyl

InChI

InChI=1S/C7H14O2/c1-6(2)5-7-8-3-4-9-7/h6-7H,3-5H2,1-2H3

InChI Key

NLSSIIZCHYEPNV-UHFFFAOYSA-N

Formula

C7H14O2

SMILES

CC(C)CC1OCCO1

Molecular Weight¹

130.18

Other Names

• 1,3-Dioxolane, 2-(2-methylpropyl)

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	20.26	kJ/mol	Joback Calculated Property
logPoct/wat	1.405		Crippen Calculated Property
McVol	110.370	ml/mol	McGowan Calculated Property
Inp	[898.00; 946.00]
Inp	932.00		NIST
Inp	946.00		NIST
Inp	901.00		NIST
Inp	906.00		NIST
Inp	898.00		NIST
Inp	932.00		NIST
Inp	898.00		NIST
Tboil	416.35	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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	[234.94; 313.66]	J/mol×K	[428.50; 628.33]
Cp,gas	234.94	J/mol×K	428.50	Joback Calculated Property
Cp,gas	249.82	J/mol×K	461.80	Joback Calculated Property
Cp,gas	263.97	J/mol×K	495.11	Joback Calculated Property
Cp,gas	277.40	J/mol×K	528.41	Joback Calculated Property
Cp,gas	290.15	J/mol×K	561.72	Joback Calculated Property
Cp,gas	302.23	J/mol×K	595.02	Joback Calculated Property
Cp,gas	313.66	J/mol×K	628.33	Joback Calculated Property
η	[0.0003968; 0.0088142]	Pa×s	[217.69; 428.50]
η	0.0088142	Pa×s	217.69	Joback Calculated Property
η	0.0036711	Pa×s	252.82	Joback Calculated Property
η	0.0018933	Pa×s	287.96	Joback Calculated Property
η	0.0011277	Pa×s	323.10	Joback Calculated Property
η	0.0007436	Pa×s	358.23	Joback Calculated Property
η	0.0005282	Pa×s	393.37	Joback Calculated Property
η	0.0003968	Pa×s	428.50	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,3-Dioxolane, 2-isobutyl.

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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