- InChI
- InChI=1S/C9H10O2/c1-2-9(10)11-8-6-4-3-5-7-8/h3-7H,2H2,1H3
- InChI Key
- DYUMLJSJISTVPV-UHFFFAOYSA-N
- Formula
- C9H10O2
- SMILES
- CCC(=O)Oc1ccccc1
- Molecular Weight1
- 150.17
- CAS
- 637-27-4
- Other Names
-
- Propionic acid, phenyl ester
- Phenyl propionate
- Phenyl propanoate
- 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.
- I : 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° | -96.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -237.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.89 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.06 | kJ/mol | Joback Calculated Property |
| log10WS | -2.20 | Crippen Calculated Property | |
| logPoct/wat | 2.002 | Crippen Calculated Property | |
| McVol | 121.350 | ml/mol | McGowan Calculated Property |
| Pc | 3439.94 | kPa | Joback Calculated Property |
| Inp | [1151.00; 1151.00] |
|
|
| Inp | 1151.00 | NIST | |
| Inp | 1151.00 | NIST | |
| I | 1720.00 | NIST | |
| Tboil | 485.15 ± 1.00 | K | NIST |
| Tc | 724.46 | K | Joback Calculated Property |
| Tfus | 292.70 ± 1.00 | K | NIST |
| Vc | 0.456 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [256.39; 321.72] | J/mol×K | [508.29; 724.46] |
|
| Cp,gas | 256.39 | J/mol×K | 508.29 | Joback Calculated Property |
| Cp,gas | 269.00 | J/mol×K | 544.32 | Joback Calculated Property |
| Cp,gas | 280.90 | J/mol×K | 580.35 | Joback Calculated Property |
| Cp,gas | 292.11 | J/mol×K | 616.37 | Joback Calculated Property |
| Cp,gas | 302.63 | J/mol×K | 652.40 | Joback Calculated Property |
| Cp,gas | 312.50 | J/mol×K | 688.43 | Joback Calculated Property |
| Cp,gas | 321.72 | J/mol×K | 724.46 | Joback Calculated Property |
| η | [0.0002308; 0.0023343] | Pa×s | [289.77; 508.29] |
|
| η | 0.0023343 | Pa×s | 289.77 | Joback Calculated Property |
| η | 0.0012799 | Pa×s | 326.19 | Joback Calculated Property |
| η | 0.0007918 | Pa×s | 362.61 | Joback Calculated Property |
| η | 0.0005347 | Pa×s | 399.03 | Joback Calculated Property |
| η | 0.0003856 | Pa×s | 435.45 | Joback Calculated Property |
| η | 0.0002925 | Pa×s | 471.87 | Joback Calculated Property |
| η | 0.0002308 | Pa×s | 508.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Propanoic acid, phenyl ester.
Sources
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