Chemical Properties of 1,3-Dioxepin (CAS 291-92-9)

1,3-Dioxepin

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InChI
InChI=1S/C5H6O2/c1-2-4-7-5-6-3-1/h1-4H,5H2
InChI Key
GTPWYANJPNGAAY-UHFFFAOYSA-N
Formula
C5H6O2
SMILES
C1=COCOC=C1
Molecular Weight1
98.10
CAS
291-92-9
Sources

Physical Properties

Property Value Unit Source
Δf -101.04 kJ/mol Joback Calculated Property
Δfgas -226.47 kJ/mol Joback Calculated Property
Δfus 15.77 kJ/mol Joback Calculated Property
Δvap 37.24 kJ/mol Joback Calculated Property
IE 8.00 eV NIST
IE 8.30 eV NIST
logPoct/wat 1.02 Crippen Calculated Property
Pc 5243.40 kPa Joback Calculated Property
Tboil 394.51 K Joback Calculated Property
Tc 616.11 K Joback Calculated Property
Tfus 208.87 K Joback Calculated Property
Vc 0.26 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 127.60 J/mol×K 394.51 Joback Calculated Property
η 0.00 Pa×s 394.51 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (ring) 2
-CH2- (ring) 1
=CH- (ring) 4

Similar Compounds

1-Propene, 1-(methoxymethoxy)-, (Z)-. 1-Methoxy-1,3-butadiene. 1-Propene, 1-(dimethoxymethoxy)-, (E)-. Dimethyl(E)-1-propenyl orthoformate. 1-Propene, 1-(1-methoxyethoxy)-, (Z)-. 1,3-Butadiene, 1-ethoxy-, (E). cis-1,3-Butadien-1-yl ethyl ether. 1,3-Dioxole, 4-methyl-. 1-Propene, 1-(1-methoxy-1-methylethoxy)-, (Z)-. 1-Propene, 1-(ethenyloxy)-, (Z)-. (E) 1-Propenylvinylether. Ketene, dimethyl-, dimethyl acetal. 2H-Pyran. (E,Z) Di-1-propenyl methyl orthoacetate. 1-Propene, 1,1'-[(1-methoxyethylidene)bis(oxy)]bis-, (Z,Z)-.

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