Chemical Properties of Propionaldehyde, dipropargal acetal (CAS 4033-07-2)

InChI

InChI=1S/C9H12O2/c1-4-7-10-9(6-3)11-8-5-2/h1-2,9H,6-8H2,3H3

InChI Key

SPAJYYACTLORPH-UHFFFAOYSA-N

Formula

C9H12O2

SMILES

C#CCOC(CC)OCC#C

Molecular Weight¹

152.19

CAS

4033-07-2

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion 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

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, 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	[265.92; 326.67]	J/mol×K	[429.96; 620.71]
Cp,gas	265.92	J/mol×K	429.96	Joback Calculated Property
Cp,gas	277.08	J/mol×K	461.75	Joback Calculated Property
Cp,gas	287.82	J/mol×K	493.54	Joback Calculated Property
Cp,gas	298.14	J/mol×K	525.33	Joback Calculated Property
Cp,gas	308.06	J/mol×K	557.13	Joback Calculated Property
Cp,gas	317.56	J/mol×K	588.92	Joback Calculated Property
Cp,gas	326.67	J/mol×K	620.71	Joback Calculated Property

Similar Compounds

Find more compounds similar to Propionaldehyde, dipropargal acetal.

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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