Chemical Properties of trans-2,3-epoxyheptanal

InChI

InChI=1S/C7H12O2/c1-2-3-4-6-7(5-8)9-6/h5-7H,2-4H2,1H3/t6-,7-/m1/s1

InChI Key

JSGLRFSEKUNPRD-BQBZGAKWSA-N

Formula

C7H12O2

SMILES

CCCC[C@H]1O[C@@H]1C=O

Molecular Weight¹

128.17

• 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.
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, 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	[230.70; 295.14]	J/mol×K	[437.44; 623.60]
Cp,gas	230.70	J/mol×K	437.44	Joback Calculated Property
Cp,gas	242.87	J/mol×K	468.47	Joback Calculated Property
Cp,gas	254.44	J/mol×K	499.49	Joback Calculated Property
Cp,gas	265.43	J/mol×K	530.52	Joback Calculated Property
Cp,gas	275.86	J/mol×K	561.55	Joback Calculated Property
Cp,gas	285.76	J/mol×K	592.57	Joback Calculated Property
Cp,gas	295.14	J/mol×K	623.60	Joback Calculated Property
η	[0.0006121; 0.0017719]	Pa×s	[250.92; 437.44]
η	0.0017719	Pa×s	250.92	Joback Calculated Property
η	0.0013462	Pa×s	282.01	Joback Calculated Property
η	0.0010801	Pa×s	313.09	Joback Calculated Property
η	0.0009017	Pa×s	344.18	Joback Calculated Property
η	0.0007757	Pa×s	375.27	Joback Calculated Property
η	0.0006828	Pa×s	406.35	Joback Calculated Property
η	0.0006121	Pa×s	437.44	Joback Calculated Property

Similar Compounds

Find more compounds similar to trans-2,3-epoxyheptanal.

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

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