Chemical Properties of 1,3-Dioxane, 4,4-dimethyl- (CAS 766-15-4)

1,3-Dioxane, 4,4-dimethyl-

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C6H12O2/c1-6(2)3-4-7-5-8-6/h3-5H2,1-2H3
InChI Key
GDKSTFXHMBGCPG-UHFFFAOYSA-N
Formula
C6H12O2
SMILES
CC1(C)CCOCO1
Molecular Weight1
116.16
CAS
766-15-4
Other Names
  • 4,4-Dimethyl-1,3-dioxane
  • 4,4-Dimethyl-m-dioxane
  • 4,4-Dimethyldioxane-1,3
  • m-Dioxane, 4,4-dimethyl-
Sources

Physical Properties

Property Value Unit Source
Δf -153.64 kJ/mol Joback Calculated Property
Δfgas -361.61 kJ/mol Joback Calculated Property
Δfus 12.79 kJ/mol Joback Calculated Property
Δvap 37.25 kJ/mol Joback Calculated Property
IE 9.80 eV NIST
logPoct/wat 1.16 Crippen Calculated Property
Pc 4098.62 kPa Joback Calculated Property
Tboil 406.50 ± 0.60 K NIST
Tboil 406.15 ± 1.50 K NIST
Tc 625.18 K Joback Calculated Property
Tfus 241.80 K Joback Calculated Property
Vc 0.34 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 194.00 J/mol×K 410.37 Joback Calculated Property
ΔvapH 37.10 kJ/mol 370.0 NIST
ΔvapH 38.80 kJ/mol 384.5 NIST

Molecular Descriptors

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

Similar Compounds

1,3-Dioxane, 4-methyl-. trans-4,6-Dimethyl-1,3-dioxane. 1,3-Dioxane, 4,6-dimethyl-, cis-. 3-Methoxy-3-methylbutanol. trans 4,5-Dimethyl-1,3-dioxane. 1,3-Dioxane, 4,5-dimethyl-. cis 4,5-Dimethyl-1,3-dioxane. 4-Methoxy-4-methyl-2-pentanol. 1,3-Dioxane, 4-(2-methylpropyl). 1,3-Dioxane, 2,4-dimethyl-. cis-2,4-Dimethyl-1,3-dioxane. m-Dioxane, 2,4-dimethyl-, trans-. 4,4,6-Trimethyl-2-vinyl-1,3-dioxane. 1,3-Dioxane, 4-(1-methylethyl). 1,3-Dioxane,2,4,6-trimethyl-,(2«alpha»,4«alpha»,6«beta»)-.

Find more compounds similar to 1,3-Dioxane, 4,4-dimethyl-.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.