- InChI
- InChI=1S/C14H16O4/c1-11(15)17-10-6-5-8-13-7-3-4-9-14(13)18-12(2)16/h3-7,9H,8,10H2,1-2H3/b6-5+
- InChI Key
- CGXXIBNEDSBELJ-AATRIKPKSA-N
- Formula
- C14H16O4
- SMILES
- CC(=O)OCC=CCc1ccccc1OC(C)=O
- Molecular Weight1
- 248.27
- 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).
- 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).
- Inp : Non-polar retention indices.
- 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 |
|---|---|---|---|
| ΔfG° | -217.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -479.61 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.97 | kJ/mol | Joback Calculated Property |
| log10WS | -2.98 | Crippen Calculated Property | |
| logPoct/wat | 2.274 | Crippen Calculated Property | |
| McVol | 194.940 | ml/mol | McGowan Calculated Property |
| Pc | 2263.26 | kPa | Joback Calculated Property |
| Inp | 1920.00 | NIST | |
| Tboil | 708.12 | K | Joback Calculated Property |
| Tc | 921.39 | K | Joback Calculated Property |
| Tfus | 425.72 | K | Joback Calculated Property |
| Vc | 0.740 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [516.56; 586.30] | J/mol×K | [708.12; 921.39] | 
|
| Cp,gas | 516.56 | J/mol×K | 708.12 | Joback Calculated Property |
| Cp,gas | 530.37 | J/mol×K | 743.66 | Joback Calculated Property |
| Cp,gas | 543.28 | J/mol×K | 779.21 | Joback Calculated Property |
| Cp,gas | 555.31 | J/mol×K | 814.75 | Joback Calculated Property |
| Cp,gas | 566.47 | J/mol×K | 850.30 | Joback Calculated Property |
| Cp,gas | 576.79 | J/mol×K | 885.84 | Joback Calculated Property |
| Cp,gas | 586.30 | J/mol×K | 921.39 | Joback Calculated Property |
| η | [0.0001029; 0.0009071] | Pa×s | [425.72; 708.12] |
|
| η | 0.0009071 | Pa×s | 425.72 | Joback Calculated Property |
| η | 0.0005268 | Pa×s | 472.79 | Joback Calculated Property |
| η | 0.0003376 | Pa×s | 519.85 | Joback Calculated Property |
| η | 0.0002329 | Pa×s | 566.92 | Joback Calculated Property |
| η | 0.0001701 | Pa×s | 613.99 | Joback Calculated Property |
| η | 0.0001299 | Pa×s | 661.05 | Joback Calculated Property |
| η | 0.0001029 | Pa×s | 708.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Oxprenolol desamino, hydroxy, desalkyl - H2O, acetylated.
Sources
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