Chemical Properties of Ethanal, ethyl linalyl acetal, # 1

Ethanal, ethyl linalyl acetal, # 1

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InChI
InChI=1S/C14H26O2/c1-7-14(6,11-9-10-12(3)4)16-13(5)15-8-2/h7,10,13H,1,8-9,11H2,2-6H3
InChI Key
ZJPKYCLAROITRY-UHFFFAOYSA-N
Formula
C14H26O2
SMILES
C=CC(C)(CCC=C(C)C)OC(C)OCC
Molecular Weight1
226.35
Sources

Physical Properties

Property Value Unit Source
Δf 16.91 kJ/mol Joback Calculated Property
Δfgas -377.90 kJ/mol Joback Calculated Property
Δfus 21.07 kJ/mol Joback Calculated Property
Δvap 49.26 kJ/mol Joback Calculated Property
logPoct/wat 4.08 Crippen Calculated Property
Pc 1639.10 kPa Joback Calculated Property
Tboil 561.61 K Joback Calculated Property
Tc 744.44 K Joback Calculated Property
Tfus 258.62 K Joback Calculated Property
Vc 0.80 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 530.49 J/mol×K 561.61 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
=C< 1
=CH2 1
-CH2- 3
>C< 1
=CH- 2
-CH3 5

Similar Compounds

1,6-Octadiene, 3-(1-ethoxyethoxy)-3,7-dimethyl-. ETHYL LINALOOL. 1,6-Octadien-3-ol, 3,7-dimethyl-, acetate. 1,5-dimethyl-1-vinylhept-4-enyl acetate. Linalool, methyl ether. linalyl methyl ether. 1,3-Dioxane, 4-ethenyl-2,6-dimethyl-, (2«alpha»,4«beta»,6«alpha»)-. 2«alpha»,4«alpha»-Dimethyl-6«beta»-vinyl-1,3-dioxane. 1,6-Octadien-3-ol, 3,7-dimethyl-, propanoate. Nerolidyl acetate. (Z)-Nerolidyl acetate. trans-Nerolidyl Acetate. 1,5-Dimethyl-1-vinyl-4-hexenyl butyrate. (Z)-Nerolidol acetate. Pentanoic acid, 1-ethenyl-1,5-dimethyl-4-hexenyl ester.

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