- InChI
- InChI=1S/C11H14O3/c1-3-11(12)14-8-9-4-6-10(13-2)7-5-9/h4-7H,3,8H2,1-2H3
- InChI Key
- YWIJRJQYADFRTL-UHFFFAOYSA-N
- Formula
- C11H14O3
- SMILES
- CCC(=O)OCc1ccc(OC)cc1
- Molecular Weight1
- 194.23
- Other Names
-
- Benzenemethanol, 4-methoxy-, propanoate
- p-Methoxybenzyl propionate
- Benzyl alcohol, p-methoxy-, propionate
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.6084 | Relay (1.0) Calculated Property | |
| ΔfG° | -270.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -451.68 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.40 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.16 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.55 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.148 | Crippen Calculated Property | |
| McVol | 155.400 | ml/mol | McGowan Calculated Property |
| Pc | 2576.72 | kPa | Joback Calculated Property |
| Inp | [1482.00; 1482.00] |
|
|
| Inp | 1482.00 | NIST | |
| Inp | 1482.00 | NIST | |
| I | [2175.00; 2205.00] |
|
|
| I | 2175.00 | NIST | |
| I | 2205.00 | NIST | |
| I | 2205.00 | NIST | |
| Tboil | 537.15 | K | Relay (1.0) Calculated Property |
| Tc | 737.30 | K | Relay (1.0) Calculated Property |
| Tfus | 271.35 | K | Relay (1.0) Calculated Property |
| Vc | 0.579 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [366.48; 440.47] | J/mol×K | [563.58; 769.30] |
|
| Cp,gas | 366.48 | J/mol×K | 563.58 | Joback Calculated Property |
| Cp,gas | 380.67 | J/mol×K | 597.87 | Joback Calculated Property |
| Cp,gas | 394.12 | J/mol×K | 632.15 | Joback Calculated Property |
| Cp,gas | 406.82 | J/mol×K | 666.44 | Joback Calculated Property |
| Cp,gas | 418.78 | J/mol×K | 700.73 | Joback Calculated Property |
| Cp,gas | 429.99 | J/mol×K | 735.01 | Joback Calculated Property |
| Cp,gas | 440.47 | J/mol×K | 769.30 | Joback Calculated Property |
| η | [0.0001448; 0.0018286] | Pa×s | [317.23; 563.58] |
|
| η | 0.0018286 | Pa×s | 317.23 | Joback Calculated Property |
| η | 0.0009406 | Pa×s | 358.29 | Joback Calculated Property |
| η | 0.0005547 | Pa×s | 399.35 | Joback Calculated Property |
| η | 0.0003610 | Pa×s | 440.40 | Joback Calculated Property |
| η | 0.0002528 | Pa×s | 481.46 | Joback Calculated Property |
| η | 0.0001872 | Pa×s | 522.52 | Joback Calculated Property |
| η | 0.0001448 | Pa×s | 563.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Anisyl propionate.
Sources
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