Chemical Properties of 6,8-Dioxabicyclo[3.2.1]octane, 7-ethyl-5-methyl-, (1R-exo)- (CAS 20290-99-7)

6,8-Dioxabicyclo[3.2.1]octane, 7-ethyl-5-methyl-, (1R-exo)-

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InChI
InChI=1S/C9H16O2/c1-3-7-8-5-4-6-9(2,10-7)11-8/h7-8H,3-6H2,1-2H3
InChI Key
YONXEBYXWVCXIV-UHFFFAOYSA-N
Formula
C9H16O2
SMILES
CCC1OC2(C)CCCC1O2
Molecular Weight1
156.22
CAS
20290-99-7
Other Names
  • exo-Brevicomin
  • Brevicomin
  • exo-7-Ethyl-5-methyl-6,8-dioxabicyclo[3.2.1]octane
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Physical Properties

Property Value Unit Source
ω 0.3696 Relay (... Calculated Property
ΔfG° -63.24 kJ/mol Joback Calculated Property
ΔfH°gas -429.31 kJ/mol Relay (... Calculated Property
ΔfusH° 21.87 kJ/mol Joback Calculated Property
ΔvapH° 49.62 kJ/mol Relay (... Calculated Property
IE 9.36 eV Relay (... Calculated Property
log10WS -2.02 Relay (... Calculated Property
logPoct/wat 2.081 Crippen Calculated Property
McVol 127.690 ml/mol McGowan Calculated Property
Pc 3163.27 kPa Joback Calculated Property
Tboil 460.18 K Relay (... Calculated Property
Tc 672.25 K Relay (... Calculated Property
Tfus 251.16 K Relay (... Calculated Property
Vc 0.500 m3/kmol Relay (... Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [308.21; 400.59] J/mol×K [476.81; 691.82] Show Hide
Cp,gas 308.21 J/mol×K 476.81 Joback Calculated Property
Cp,gas 326.46 J/mol×K 512.64 Joback Calculated Property
Cp,gas 343.39 J/mol×K 548.48 Joback Calculated Property
Cp,gas 359.13 J/mol×K 584.31 Joback Calculated Property
Cp,gas 373.82 J/mol×K 620.15 Joback Calculated Property
Cp,gas 387.60 J/mol×K 655.98 Joback Calculated Property
Cp,gas 400.59 J/mol×K 691.82 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 370.50 ± 2.50 K 14.70 NIST

Similar Compounds

7,7-dimethyl-6,8-dioxa-bicyclo[ 3.2.1]octane. 1,3-Dioxane, 2-ethyl-2methyl-4-pentyl, 2R,4R. 1,3-Dioxane, 2-ethyl-2-methyl-4-pentyl, 2S,4R. (-)-1,2:5,6-Di-O-cyclohexylidene-L-inositol, diacetate. 1,6-dioxaspiro [4,5] decane, 7-methyl. Conophthorin. (-)-1,2:5,6-Di-O-cyclohexylidene-L-inositol, bis(trifluoroacetate). Chalcogran, isomer # 1. Chalcogran, isomer # 2. Cyclohexanone-1,3-butanediol ketal. 1,3-Dioxane, 2,2-dimethyl-4-pentyl, 4R. 1,3-Dioxane, 2,4-pentyl, 2R,4R. 1,3-Dioxane, 2,4-dipentyl, 2S,4R. 1,3-Dioxane, 2-propyl-4-pentyl, 2S,4R. 1,3-Dioxane, 2-propyl-4-pentyl, 2R,4R.

Find more compounds similar to 6,8-Dioxabicyclo[3.2.1]octane, 7-ethyl-5-methyl-, (1R-exo)-.

Sources

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