Chemical Properties of 1,3-Dioxane, 2-propyl-4-(2-pentenyl), 2R,4R

1,3-Dioxane, 2-propyl-4-(2-pentenyl), 2R,4R

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InChI
InChI=1S/C12H22O2/c1-3-5-6-8-11-9-10-13-12(14-11)7-4-2/h5-6,11-12H,3-4,7-10H2,1-2H3/b6-5+/t11-,12-/m0/s1
InChI Key
HUMNXQDSONGUJF-WTIVYXKASA-N
Formula
C12H22O2
SMILES
CCC=CCC1CCOC(CCC)O1
Molecular Weight1
198.30
Sources

Physical Properties

Property Value Unit Source
Δf -25.12 kJ/mol Joback Calculated Property
Δfgas -403.81 kJ/mol Joback Calculated Property
Δfus 35.90 kJ/mol Joback Calculated Property
Δvap 51.40 kJ/mol Joback Calculated Property
logPoct/wat 3.27 Crippen Calculated Property
Pc 2135.43 kPa Joback Calculated Property
Tboil 546.90 K Joback Calculated Property
Tc 745.76 K Joback Calculated Property
Tfus 276.20 K Joback Calculated Property
Vc 0.66 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 449.13 J/mol×K 546.9 Joback Calculated Property
η 0.00 Pa×s 546.9 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (ring) 2
-CH2- 4
=CH- 2
-CH3 2
>CH- (ring) 2
-CH2- (ring) 2

Similar Compounds

1,3-Dioxane, 2-propyl-4-(2-pentenyl), 2S,4R. 1,3-Dioxane, 2-ethyl-4-(2-pentenyl), 2S,4R. 1,3-Dioxane, 2-ethyl-4-(2-pentenyl), 2R,4R. 1,3-Dioxane, 2-pentyl-4-(2-pentenyl), 2R,4R. 1,3-Dioxane, 2-pentyl-4-(2-pentenyl), 2S,4R. 1,3-Dioxane, 2-isopentyl-4-(2-pentenyl), 2S,4R. 1,3-Dioxane, 2-isopentyl-4-(2-pentenyl), 2R,4R. 1,3-Dioxane, 2-isopropyl-4-(2-pentenyl), 2R,4R. 1,3-Dioxane, 2-isopropyl-4-(2-pentenyl), 2S,4R. 1,3-Dioxane, 2-ethyl-2-methyl-4-(2-pentenyl), 2R,4R. 1,3-Dioxane, 2-ethyl-2-methyl-4-(2-pentenyl), 2S,4R. 1,3-Dioxane, 2-(1-methylbutyl)-4-(2-pentenyl), 2R,4R. 1,3-Dioxane, 2-(1-methylbutyl)-4-(2-pentenyl), 2S,4R. 1,3-Dioxane, 2,2-dimethyl-4-(2-pentenyl), 4R. 1,3-Dioxane, 2-propyl-4-pentyl, 2R,4R.

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