Chemical Properties of neral propylene glycol acetal (isomer)

neral propylene glycol acetal (isomer)

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InChI
InChI=1S/C14H24O2/c1-11(2)6-5-7-12(3)8-9-14-15-10-13(4)16-14/h6,8,13-14H,5,7,9-10H2,1-4H3/b12-8-
InChI Key
SOLUPKFWUPOIEI-WQLSENKSSA-N
Formula
C14H24O2
SMILES
CC(C)=CCCC(C)=CCC1OCC(C)O1
Molecular Weight1
224.34
Sources

Physical Properties

Property Value Unit Source
Δf 66.94 kJ/mol Joback Calculated Property
Δfgas -341.29 kJ/mol Joback Calculated Property
Δfus 40.76 kJ/mol Joback Calculated Property
Δvap 55.80 kJ/mol Joback Calculated Property
logPoct/wat 3.83 Crippen Calculated Property
Pc 1859.51 kPa Joback Calculated Property
Tboil 592.31 K Joback Calculated Property
Tc 794.04 K Joback Calculated Property
Tfus 269.26 K Joback Calculated Property
Vc 0.76 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 531.62 J/mol×K 592.31 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (ring) 2
=C< 2
-CH2- 3
=CH- 2
-CH3 4
>CH- (ring) 2
-CH2- (ring) 1

Similar Compounds

geranial propylene glycol acetal (isomer). cis-2-Thyl-4-methyl-1,3-dioxolane. 1,3-Dioxolane, 2-ethyl-4-methyl-. 1,3-Dioxolane, 4-methyl-2-propyl, cis. 1,3-Dioxolane, 2-butyl-4-methyl-. 1,3-Dioxolane, 4-methyl-2-(2-methylpropyl), trans. 1,3-Dioxolane, 4-methyl-2-(1-methylethyl), cis. cis-2-Isopropyl-4-methyl-1,3-dioxolane. cis-2-Tert-butyl-4-methyl-1,3-dioxolane. cis-3-Hexenal diethyl acetal. 1,3-Dioxolane, 4-methyl-2-(1-methylpropyl), cis. 1,3-Dioxolane, 4-methyl-2-(1-methylpropyl), trans. 1,3-Dioxane, 2-ethyl-4-(2-pentenyl), 2S,4R. 1,3-Dioxane, 2-ethyl-4-(2-pentenyl), 2R,4R. 1,3-Dioxane, 2-propyl-4-(2-pentenyl), 2S,4R.

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