- InChI
- InChI=1S/C14H18O3/c1-2-3-4-11-17-13-8-5-12(6-9-13)7-10-14(15)16/h5-10H,2-4,11H2,1H3,(H,15,16)/b10-7+
- InChI Key
- WXPBGFBUVHLMSK-JXMROGBWSA-N
- Formula
- C14H18O3
- SMILES
- CCCCCOc1ccc(C=CC(=O)O)cc1
- Molecular Weight1
- 234.29
- CAS
- 62718-63-2
- 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).
- 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 | 0.8746 | Relay (... Calculated Property | |
| ΔfG° | -120.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -492.64 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 32.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.46 | kJ/mol | Relay (... Calculated Property |
| IE | 8.26 | eV | Relay (... Calculated Property |
| log10WS | -4.06 | Relay (... Calculated Property | |
| logPoct/wat | 3.353 | Crippen Calculated Property | |
| McVol | 193.370 | ml/mol | McGowan Calculated Property |
| Pc | 2365.67 | kPa | Joback Calculated Property |
| Tboil | 623.66 | K | Relay (... Calculated Property |
| Tc | 816.40 | K | Relay (... Calculated Property |
| Tfus | 405.70 | K | Relay (... Calculated Property |
| Vc | 0.680 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [529.94; 595.82] | J/mol×K | [724.01; 921.62] | 
|
| Cp,gas | 529.94 | J/mol×K | 724.01 | Joback Calculated Property |
| Cp,gas | 542.69 | J/mol×K | 756.95 | Joback Calculated Property |
| Cp,gas | 554.70 | J/mol×K | 789.88 | Joback Calculated Property |
| Cp,gas | 565.98 | J/mol×K | 822.82 | Joback Calculated Property |
| Cp,gas | 576.57 | J/mol×K | 855.75 | Joback Calculated Property |
| Cp,gas | 586.51 | J/mol×K | 888.69 | Joback Calculated Property |
| Cp,gas | 595.82 | J/mol×K | 921.62 | Joback Calculated Property |
| η | [0.0000291; 0.0012903] | Pa×s | [414.38; 724.01] |
|
| η | 0.0012903 | Pa×s | 414.38 | Joback Calculated Property |
| η | 0.0004832 | Pa×s | 465.99 | Joback Calculated Property |
| η | 0.0002201 | Pa×s | 517.59 | Joback Calculated Property |
| η | 0.0001156 | Pa×s | 569.19 | Joback Calculated Property |
| η | 0.0000676 | Pa×s | 620.80 | Joback Calculated Property |
| η | 0.0000429 | Pa×s | 672.40 | Joback Calculated Property |
| η | 0.0000291 | Pa×s | 724.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to p-Pentyloxycinnamic acid.
Sources
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