Chemical Properties of Butyric acid,4-hydroxy-2-(o-hydroxyphenyl)-2-phenyl-,gamma-lactone (CAS 93011-89-3)

Butyric acid,4-hydroxy-2-(o-hydroxyphenyl)-2-phenyl-,gamma-lactone

InChI
InChI=1S/C16H14O3/c17-14-9-5-4-8-13(14)16(10-11-19-15(16)18)12-6-2-1-3-7-12/h1-9,17H,10-11H2
InChI Key
QAKIRMAQWBIBDQ-UHFFFAOYSA-N
Formula
C16H14O3
SMILES
O=C1OCCC1(c1ccccc1)c1ccccc1O
Molecular Weight1
254.28
CAS
93011-89-3
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Physical Properties

Property Value Unit Source
ΔfusH° 27.27 kJ/mol Joback Calculated Property
logPoct/wat 2.625 Crippen Calculated Property
McVol 191.230 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [236.24; 625.33] 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-1.63210e+02
Coefficient B1.90860e+00
Coefficient C-1.82356e-03
Coefficient D7.03500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 236.24 J/mol×K 273.00 Calculated Property
Cp,gas 314.93 J/mol×K 353.78 Calculated Property
Cp,gas 379.55 J/mol×K 434.56 Calculated Property
Cp,gas 432.35 J/mol×K 515.33 Calculated Property
Cp,gas 475.55 J/mol×K 596.11 Calculated Property
Cp,gas 511.36 J/mol×K 676.89 Calculated Property
Cp,gas 542.03 J/mol×K 757.67 Calculated Property
Cp,gas 569.76 J/mol×K 838.44 Calculated Property
Cp,gas 596.78 J/mol×K 919.22 Calculated Property
Cp,gas 625.33 J/mol×K 1000.00 Calculated Property

Similar Compounds

Furan-2(3h)-one, 5- (bromomethyl)-4,5-dihydro-3-(o-hydroxyphenyl)-3-phenyl-. 2,6-Methano-1,4-benzodioxocin-5(6h)-one, 2,3-dihydro-6-phenyl-. Benzofuranone, 2(3h)-, 3-(beta-benzyloxyethyl)-3-phenyl-. 3-(Beta-methoxyethyl)-3-phenyl-2-benzofuranone. 1-Benzoxepin-5-carboxylic acid,2,3,4,5-tetrahydro-3-hydroxy-5-phenyl-,gamma-lactone. Cinchonine. Cinchonidine. Cytidine, dimethyl-TMS derivative. 3-(Beta-morpholinoethyl)-3-phenyl-2-benzofuranone. azadirachtin. N6-(cyclotetramethylene-tertbutylsilyl)-2'-Deoxyadenosine, 3',5'-bis-O-TBDMS. Nalmefene, bis(trifluoroacetate). Epibaptifoline. Baptifoline. Argentamin.

Find more compounds similar to Butyric acid,4-hydroxy-2-(o-hydroxyphenyl)-2-phenyl-,gamma-lactone.

Sources

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