Chemical Properties of trans-2-Methyl-5-butyl-1,3-dioxane (CAS 39087-22-4)

InChI

InChI=1S/C9H18O2/c1-3-4-5-9-6-10-8(2)11-7-9/h8-9H,3-7H2,1-2H3/t8-,9-

InChI Key

IJCIOLXHDMCLLI-KYZUINATSA-N

Formula

C9H18O2

SMILES

CCCCC1COC(C)OC1

Molecular Weight¹

158.24

CAS

39087-22-4

• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[321.52; 415.85]	J/mol×K	[474.10; 671.99]
Cp,gas	321.52	J/mol×K	474.10	Joback Calculated Property
Cp,gas	339.22	J/mol×K	507.08	Joback Calculated Property
Cp,gas	356.12	J/mol×K	540.06	Joback Calculated Property
Cp,gas	372.22	J/mol×K	573.04	Joback Calculated Property
Cp,gas	387.53	J/mol×K	606.03	Joback Calculated Property
Cp,gas	402.07	J/mol×K	639.01	Joback Calculated Property
Cp,gas	415.85	J/mol×K	671.99	Joback Calculated Property
η	[0.0003243; 0.0057462]	Pa×s	[247.47; 474.10]
η	0.0057462	Pa×s	247.47	Joback Calculated Property
η	0.0025914	Pa×s	285.24	Joback Calculated Property
η	0.0014079	Pa×s	323.01	Joback Calculated Property
η	0.0008692	Pa×s	360.78	Joback Calculated Property
η	0.0005879	Pa×s	398.56	Joback Calculated Property
η	0.0004255	Pa×s	436.33	Joback Calculated Property
η	0.0003243	Pa×s	474.10	Joback Calculated Property

Similar Compounds

Find more compounds similar to trans-2-Methyl-5-butyl-1,3-dioxane.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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