Chemical Properties of 2,3-Dioxabicyclo[2.2.1]heptane (CAS 279-35-6)

2,3-Dioxabicyclo[2.2.1]heptane

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InChI
InChI=1S/C5H8O2/c1-2-5-3-4(1)6-7-5/h4-5H,1-3H2
InChI Key
RNFXAEBUWFIOQW-UHFFFAOYSA-N
Formula
C5H8O2
SMILES
C1CC2CC1OO2
Molecular Weight1
100.12
CAS
279-35-6
Sources

Physical Properties

Property Value Unit Source
Δf -71.62 kJ/mol Joback Calculated Property
Δfgas -271.09 kJ/mol Joback Calculated Property
Δfus 18.83 kJ/mol Joback Calculated Property
Δvap 35.74 kJ/mol Joback Calculated Property
IE 8.96 eV NIST
IE 8.96 eV NIST
IE 8.99 eV NIST
logPoct/wat 0.87 Crippen Calculated Property
Pc 4883.38 kPa Joback Calculated Property
Tboil 385.45 K Joback Calculated Property
Tc 593.06 K Joback Calculated Property
Tfus 231.61 K Joback Calculated Property
Vc 0.26 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 142.40 J/mol×K 385.45 Joback Calculated Property
η 0.00 Pa×s 385.45 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (ring) 2
>CH- (ring) 2
-CH2- (ring) 3

Similar Compounds

2,3-Dioxabicyclo[2.2.2]octane. 7,8-Dioxabicyclo[4.2.2]decane. 6,7-Dioxabicyclo[3.2.2]nonane. 1,3-Cyclopentanediol, cis-. 3-Hydroperoxy-n-heptane. 2-Hydroperoxy-n-hexane. Hydroperoxide, 1-methylpentyl. 3-Hydroperoxyhexane. Hydroperoxide, 1-methylbutyl. 4-Hydroperoxy-n-heptane. Hydroperoxide, 1-methylhexyl. 2,5-Dimethyl-2-oxy-5-tert-butylperoxyhexane. 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane. 2,3-Dioxabicyclo[2.2.2]oct-5-ene. di-tert-pentyl peroxide.

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