Chemical Properties of Benzo[b]benzo[3,4]cyclobuta[1,2-e][1,4]dioxin, 4b,10a-dihydro-4b-phenyl- (CAS 53486-88-7)

Benzo[b]benzo[3,4]cyclobuta[1,2-e][1,4]dioxin, 4b,10a-dihydro-4b-phenyl-

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InChI
InChI=1S/C20H14O2/c1-2-8-14(9-3-1)20-16-11-5-4-10-15(16)19(20)21-17-12-6-7-13-18(17)22-20/h1-13,19H
InChI Key
PSQTZUPHZFJNTH-UHFFFAOYSA-N
Formula
C20H14O2
SMILES
c1ccc(C23Oc4ccccc4OC2c2ccccc23)cc1
Molecular Weight1
286.32
CAS
53486-88-7
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Physical Properties

Property Value Unit Source
ω 0.5284 Relay (... Calculated Property
ΔfG° 403.46 kJ/mol Joback Calculated Property
ΔfH°gas 79.38 kJ/mol Relay (... Calculated Property
ΔfusH° 39.03 kJ/mol Joback Calculated Property
ΔvapH° 109.46 kJ/mol Relay (... Calculated Property
IE 7.58 ± 0.02 eV NIST
log10WS -5.95 Relay (... Calculated Property
logPoct/wat 4.456 Crippen Calculated Property
McVol 211.400 ml/mol McGowan Calculated Property
Pc 2662.52 kPa Joback Calculated Property
Tboil 649.54 K Relay (... Calculated Property
Tc 1010.71 K Relay (... Calculated Property
Tfus 424.77 K Relay (... Calculated Property
Vc 0.813 m3/kmol Relay (... Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [618.55; 728.04] J/mol×K [806.08; 1082.32] Show Hide
Cp,gas 618.55 J/mol×K 806.08 Joback Calculated Property
Cp,gas 635.63 J/mol×K 852.12 Joback Calculated Property
Cp,gas 652.56 J/mol×K 898.16 Joback Calculated Property
Cp,gas 669.80 J/mol×K 944.20 Joback Calculated Property
Cp,gas 687.82 J/mol×K 990.24 Joback Calculated Property
Cp,gas 707.08 J/mol×K 1036.28 Joback Calculated Property
Cp,gas 728.04 J/mol×K 1082.32 Joback Calculated Property

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Find more compounds similar to Benzo[b]benzo[3,4]cyclobuta[1,2-e][1,4]dioxin, 4b,10a-dihydro-4b-phenyl-.

Sources

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