Chemical Properties of 1,3-Dioxane, 2-ethyl-2-methyl-4-pentyl, 2S,4R

1,3-Dioxane, 2-ethyl-2-methyl-4-pentyl, 2S,4R

InChI
InChI=1S/C12H24O2/c1-4-6-7-8-11-9-10-13-12(3,5-2)14-11/h11H,4-10H2,1-3H3/t11-,12+/m0/s1
InChI Key
DURNOWZZDBQNIF-NWDGAFQWSA-N
Formula
C12H24O2
SMILES
CCCCCC1CCOC(C)(CC)O1
Molecular Weight1
200.32
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Physical Properties

Property Value Unit Source
ω 0.4883 Relay (1.0) Calculated Property
Δf -110.83 kJ/mol Joback Calculated Property
Δfgas -543.94 kJ/mol Relay (1.0) Calculated Property
Δfus 29.40 kJ/mol Joback Calculated Property
Δvap 60.43 kJ/mol Relay (1.0) Calculated Property
IE 9.26 eV Relay (1.0) Calculated Property
log10WS -2.77 Relay (1.0) Calculated Property
logPoct/wat 3.498 Crippen Calculated Property
McVol 180.820 ml/mol McGowan Calculated Property
Pc 2121.68 kPa Joback Calculated Property
I 1485.00 NIST
Tboil 498.98 K Relay (1.0) Calculated Property
Tc 683.04 K Relay (1.0) Calculated Property
Tfus 230.07 K Relay (1.0) Calculated Property
Vc 0.685 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [466.39; 570.74] J/mol×K [542.98; 740.89] Show Hide
Cp,gas 466.39 J/mol×K 542.98 Joback Calculated Property
Cp,gas 486.11 J/mol×K 575.96 Joback Calculated Property
Cp,gas 504.78 J/mol×K 608.95 Joback Calculated Property
Cp,gas 522.50 J/mol×K 641.93 Joback Calculated Property
Cp,gas 539.34 J/mol×K 674.92 Joback Calculated Property
Cp,gas 555.39 J/mol×K 707.90 Joback Calculated Property
Cp,gas 570.74 J/mol×K 740.89 Joback Calculated Property

Similar Compounds

1,3-Dioxane, 2-ethyl-2methyl-4-pentyl, 2R,4R. 1,3-Dioxane, 2,2-dimethyl-4-pentyl, 4R. 1,3-Dioxane, 2-ethyl-4-pentyl, 2R,4R. 1,3-Dioxane, 2-ethyl-4-pentyl, 2S,4R. 1,3-Dioxane, 2-propyl-4-pentyl, 2S,4R. 1,3-Dioxane, 2-propyl-4-pentyl, 2R,4R. 1,3-Dioxane, 2,4-pentyl, 2R,4R. 1,3-Dioxane, 2,4-dipentyl, 2S,4R. 1,3-Dioxane, 2-isopropyl-4-pentyl, 2R,4R. 1,3-Dioxane, 2-isopropyl-4-pentyl, 2S,4R. 1,6-dioxaspiro [4,5] decane, 7-methyl. Conophthorin. Chalcogran, isomer # 2. Chalcogran, isomer # 1. 1,3-Dioxane, 2-isopentyl-4-pentyl, 2R,4R.

Find more compounds similar to 1,3-Dioxane, 2-ethyl-2-methyl-4-pentyl, 2S,4R.

Sources

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