Chemical Properties of 2-Propen-1-one, 3-(4-methoxyphenyl)-1-phenyl- (CAS 959-33-1)

2-Propen-1-one, 3-(4-methoxyphenyl)-1-phenyl-

InChI
InChI=1S/C16H14O2/c1-18-15-10-7-13(8-11-15)9-12-16(17)14-5-3-2-4-6-14/h2-12H,1H3/b12-9+
InChI Key
XUFXKBJMCRJATM-FMIVXFBMSA-N
Formula
C16H14O2
SMILES
COc1ccc(C=CC(=O)c2ccccc2)cc1
Molecular Weight1
238.28
CAS
959-33-1
Other Names
  • Chalcone, 4-methoxy-
  • Phenyl p-methoxystyryl ketone
  • 3-(4-Methoxyphenyl)-1-phenyl-2-propen-1-one
  • 4-Methoxychalcone
  • 4'-Methoxybenzylideneacetophenone
  • (4-Methoxybenzylidene)acetophenone
  • p-Methoxystyryl phenyl ketone
  • 4-Methoxystyryl phenyl ketone
  • (p-Methoxybenzylidene)acetophenone
  • 1-Phenyl-3-(4-methoxyphenyl)-2-propen-1-one
  • NSC 11866
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Physical Properties

Property Value Unit Source
ω 0.5854 Relay (1.0) Calculated Property
ΔcH°solid -8138.70 kJ/mol NIST
ΔfH°gas -39.49 kJ/mol Relay (1.0) Calculated Property
ΔfH°solid -195.00 kJ/mol NIST
ΔfusH° 27.88 kJ/mol Joback Calculated Property
ΔvapH° 97.94 kJ/mol Relay (1.0) Calculated Property
IE 8.14 eV Relay (1.0) Calculated Property
log10WS -4.48 Relay (1.0) Calculated Property
logPoct/wat 3.591 Crippen Calculated Property
McVol 191.920 ml/mol McGowan Calculated Property
Pc 2477.65 kPa Joback Calculated Property
Tboil 640.73 K Relay (1.0) Calculated Property
Tc 878.87 K Relay (1.0) Calculated Property
Tfus 371.93 K Relay (1.0) Calculated Property
Vc 0.683 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [494.72; 570.01] J/mol×K [704.47; 947.75] Show Hide
Cp,gas 494.72 J/mol×K 704.47 Joback Calculated Property
Cp,gas 510.09 J/mol×K 745.02 Joback Calculated Property
Cp,gas 524.23 J/mol×K 785.56 Joback Calculated Property
Cp,gas 537.22 J/mol×K 826.11 Joback Calculated Property
Cp,gas 549.13 J/mol×K 866.65 Joback Calculated Property
Cp,gas 560.04 J/mol×K 907.20 Joback Calculated Property
Cp,gas 570.01 J/mol×K 947.75 Joback Calculated Property
η [0.0001053; 0.0010692] Pa×s [402.52; 704.47] Show Hide
η 0.0010692 Pa×s 402.52 Joback Calculated Property
η 0.0005862 Pa×s 452.85 Joback Calculated Property
η 0.0003624 Pa×s 503.17 Joback Calculated Property
η 0.0002445 Pa×s 553.50 Joback Calculated Property
η 0.0001762 Pa×s 603.82 Joback Calculated Property
η 0.0001335 Pa×s 654.14 Joback Calculated Property
η 0.0001053 Pa×s 704.47 Joback Calculated Property

Similar Compounds

3-(4-Methoxyphenyl)-1-(2-naphthyl)prop-2-en-1-one. Chalcone. 2-Propen-1-one, 1,3-diphenyl-, (E)-. 2-Propen-1-one, 1-(4-bromophenyl)-3-phenyl-. (E)-1-(2-Hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one. 2-Propen-1-one, 1-(2,6-dihydroxy-4-methoxyphenyl)-3-phenyl-, (E)-. 2-Propen-1-one, 1-(2,6-dihydroxy-4-methoxyphenyl)-3-phenyl-. 1H-Phenalen-1-one. (2E)-1,3-bis(4-ethoxyphenyl)-2-buten-1-one. Chalcone, 2',4',6'-trihydroxy-4-methoxy, TMS. (E)-1-(2-Hydroxy-4,6-dimethoxyphenyl)-3-phenylprop-2-en-1-one. Pinostrobin chalcone, TMS. Chalcone, 2',4,6'-trihydroxy-4'-methoxy, TMS. Chalcone, 2',6'-dihydroxy-4,4'-dimethoxy, bis-TMS. 2'-Hydroxy-4,4',5',6'-tetramethoxychalcone.

Find more compounds similar to 2-Propen-1-one, 3-(4-methoxyphenyl)-1-phenyl-.

Sources

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