- 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
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔcH°solid | -8138.70 | kJ/mol | NIST |
| ΔfG° | 145.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -39.56 | kJ/mol | Joback Calculated Property |
| ΔfH°solid | -195.00 | kJ/mol | NIST |
| ΔfusH° | 27.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 65.54 | kJ/mol | Joback Calculated Property |
| log10WS | -4.31 | Crippen 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 | 704.27 | K | Joback Calculated Property |
| Tc | 947.48 | K | Joback Calculated Property |
| Tfus | 402.52 | K | Joback Calculated Property |
| Vc | 0.720 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [494.64; 569.95] | J/mol×K | [704.27; 947.48] | 
|
| Cp,gas | 494.64 | J/mol×K | 704.27 | Joback Calculated Property |
| Cp,gas | 510.01 | J/mol×K | 744.80 | Joback Calculated Property |
| Cp,gas | 524.16 | J/mol×K | 785.34 | Joback Calculated Property |
| Cp,gas | 537.15 | J/mol×K | 825.87 | Joback Calculated Property |
| Cp,gas | 549.06 | J/mol×K | 866.41 | Joback Calculated Property |
| Cp,gas | 559.97 | J/mol×K | 906.94 | Joback Calculated Property |
| Cp,gas | 569.95 | J/mol×K | 947.48 | Joback Calculated Property |
| η | [0.0001053; 0.0010692] | Pa×s | [402.52; 704.27] |
|
| η | 0.0010692 | Pa×s | 402.52 | Joback Calculated Property |
| η | 0.0005864 | Pa×s | 452.81 | Joback Calculated Property |
| η | 0.0003626 | Pa×s | 503.10 | Joback Calculated Property |
| η | 0.0002447 | Pa×s | 553.39 | Joback Calculated Property |
| η | 0.0001763 | Pa×s | 603.69 | Joback Calculated Property |
| η | 0.0001336 | Pa×s | 653.98 | Joback Calculated Property |
| η | 0.0001053 | Pa×s | 704.27 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Propen-1-one, 3-(4-methoxyphenyl)-1-phenyl-.
Sources
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