Chemical Properties of 2-hydroxyl-3,4,6-trimethoxy-acetophenone

2-hydroxyl-3,4,6-trimethoxy-acetophenone

InChI
InChI=1S/C11H14O5/c1-6(12)9-7(14-2)5-8(15-3)11(16-4)10(9)13/h5,13H,1-4H3
InChI Key
WLTFZNFPHXCIAO-UHFFFAOYSA-N
Formula
C11H14O5
SMILES
COc1cc(OC)c(C(C)=O)c(O)c1OC
Molecular Weight1
226.23
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Physical Properties

Property Value Unit Source
ΔfusH° 28.07 kJ/mol Joback Calculated Property
logPoct/wat 1.621 Crippen Calculated Property
McVol 167.140 ml/mol McGowan Calculated Property
Inp [1785.00; 1785.00]   Show Hide
Inp 1785.00 NIST
Inp 1785.00 NIST
Tboil 570.73 K Relay (1.0) Calculated Property
Tfus 366.49 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 [253.25; 526.12] 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 A7.68200e+01
Coefficient B7.28480e-01
Coefficient C-3.09340e-04
Coefficient D3.01600e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 253.25 J/mol×K 273.00 Calculated Property
Cp,gas 297.16 J/mol×K 353.78 Calculated Property
Cp,gas 337.44 J/mol×K 434.56 Calculated Property
Cp,gas 374.21 J/mol×K 515.33 Calculated Property
Cp,gas 407.54 J/mol×K 596.11 Calculated Property
Cp,gas 437.54 J/mol×K 676.89 Calculated Property
Cp,gas 464.30 J/mol×K 757.67 Calculated Property
Cp,gas 487.92 J/mol×K 838.44 Calculated Property
Cp,gas 508.50 J/mol×K 919.22 Calculated Property
Cp,gas 526.12 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0001207; 0.0000204] Pa×s [506.05; 638.09] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.76205e+01
Coefficient B4.35108e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.506.05
Temperature range, max.638.09
η 0.0001207 Pa×s 506.05 Calculated Property
η 0.0000947 Pa×s 520.72 Calculated Property
η 0.0000753 Pa×s 535.39 Calculated Property
η 0.0000607 Pa×s 550.06 Calculated Property
η 0.0000494 Pa×s 564.73 Calculated Property
η 0.0000406 Pa×s 579.40 Calculated Property
η 0.0000338 Pa×s 594.08 Calculated Property
η 0.0000283 Pa×s 608.75 Calculated Property
η 0.0000239 Pa×s 623.42 Calculated Property
η 0.0000204 Pa×s 638.09 Calculated Property

Similar Compounds

2,3,4,6-tetramethoxy-acetophenone. 2',3',4' Trimethoxyacetophenone. 2-hydroxyl-tetramethoxy-acetophenone. Xanthoxylin. 1-(2,4,5-Trimethoxyphenyl)propan-1-one. 2'-Hydroxy-4,4',5',6'-tetramethoxychalcone. 1-(2,4,5-Trimethoxyphenyl)butan-1-one. 2'-Hydroxy-3,3',4,4',5',6'-hexamethoxy-chalcone. Chalcone, 2'-hydroxy-3',4,4',5',6'-pentamethoxy-. Ethanone, 1-(2-hydroxy-6-methoxyphenyl)-. Acetophenone, 4'-hydroxy-2'-methoxy. 2,4,6-Trimethoxyacetophenone. Ethanone, 1-(2,5-dimethoxyphenyl)-. (E)-1-(2-Hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one. 2',4'-Dimethoxyacetophenone.

Find more compounds similar to 2-hydroxyl-3,4,6-trimethoxy-acetophenone.

Sources

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