Chemical Properties of (2E)-1,3-bis(4-hydroxyphenyl)-2-buten-1-one

(2E)-1,3-bis(4-hydroxyphenyl)-2-buten-1-one

InChI
InChI=1S/C16H14O3/c1-11(12-2-6-14(17)7-3-12)10-16(19)13-4-8-15(18)9-5-13/h2-10,17-18H,1H3/b11-10-
InChI Key
HBEIHQWBXCHEKJ-ZHACJKMWSA-N
Formula
C16H14O3
SMILES
C/C(=C\C(=O)c1ccc(O)cc1)c1ccc(O)cc1
Molecular Weight1
254.29
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Physical Properties

Property Value Unit Source
ΔfH°gas -269.83 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 37.34 kJ/mol Joback Calculated Property
ΔvapH° 131.46 kJ/mol Relay (1.0) Calculated Property
IE 7.94 eV Relay (1.0) Calculated Property
log10WS -4.04 Relay (1.0) Calculated Property
logPoct/wat 3.384 Crippen Calculated Property
McVol 197.790 ml/mol McGowan Calculated Property
Tboil 656.65 K Relay (1.0) Calculated Property
Tfus 462.08 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [251.24; 610.74] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.03820e+02
Coefficient B1.66712e+00
Coefficient C-1.48912e-03
Coefficient D5.36560e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 251.24 J/mol×K 273.00 Calculated Property
Cp,gas 323.35 J/mol×K 353.78 Calculated Property
Cp,gas 383.46 J/mol×K 434.56 Calculated Property
Cp,gas 433.27 J/mol×K 515.33 Calculated Property
Cp,gas 474.47 J/mol×K 596.11 Calculated Property
Cp,gas 508.76 J/mol×K 676.89 Calculated Property
Cp,gas 537.83 J/mol×K 757.67 Calculated Property
Cp,gas 563.39 J/mol×K 838.44 Calculated Property
Cp,gas 587.13 J/mol×K 919.22 Calculated Property
Cp,gas 610.74 J/mol×K 1000.00 Calculated Property

Similar Compounds

(2E)-1,3-bis(4-ethoxyphenyl)-2-buten-1-one. 2-Buten-1-one, 1,3-diphenyl-. (2E)-1,3-bis(3-nitrophenyl)-2-buten-1-one. Phenol, 4,4'-(1,3,3-trimethyl-1-propene-1,3-diyl)bis-. 2-Propen-1-one, 3-(4-methoxyphenyl)-1-phenyl-. 3-(4-Methoxyphenyl)-1-(2-naphthyl)prop-2-en-1-one. 2'-Hydroxy-4,4',5',6'-tetramethoxychalcone. (E)-1-(2-Hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one. (1E,2e)-1,3-bis(4-chlorophenyl)-2-buten-1-one oxime. PROPAFENONE-H2O, M(HO-)-H2O, AC. 2'-Hydroxy-3,3',4,4',5',6'-hexamethoxy-chalcone. Chalcone, 2',6'-dihydroxy-4,4'-dimethoxy, bis-TMS. (E)-1-(2-Hydroxy-4,6-dimethoxyphenyl)-3-phenylprop-2-en-1-one. 2-dehydro-O -demethylangolensin [ 1 -(2',4"-dihydroxyphenyl)-2-(4"-hydroxyphenyl)-prop-2-en- 1-one]. Ethoxyquin.

Find more compounds similar to (2E)-1,3-bis(4-hydroxyphenyl)-2-buten-1-one.

Sources

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