- InChI
- InChI=1S/C17H24O2/c1-3-4-5-7-10-15(2)19-17(18)14-13-16-11-8-6-9-12-16/h6-12,15H,3-5,13-14H2,1-2H3/b10-7+
- InChI Key
- MAKKQAYXFZLERU-JXMROGBWSA-N
- Formula
- C17H24O2
- SMILES
- CCCCC=CC(C)OC(=O)CCc1ccccc1
- Molecular Weight1
- 260.37
- 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° | 48.53 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -290.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.44 | kJ/mol | Joback Calculated Property |
| log10WS | -4.87 | Crippen Calculated Property | |
| logPoct/wat | 4.297 | Crippen Calculated Property | |
| McVol | 229.770 | ml/mol | McGowan Calculated Property |
| Pc | 1717.45 | kPa | Joback Calculated Property |
| Inp | [1829.00; 1829.00] |
|
|
| Inp | 1829.00 | NIST | |
| Inp | 1829.00 | NIST | |
| Tboil | 695.05 | K | Joback Calculated Property |
| Tc | 898.29 | K | Joback Calculated Property |
| Tfus | 359.85 | K | Joback Calculated Property |
| Vc | 0.877 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [632.80; 722.14] | J/mol×K | [695.05; 898.29] |
|
| Cp,gas | 632.80 | J/mol×K | 695.05 | Joback Calculated Property |
| Cp,gas | 650.13 | J/mol×K | 728.92 | Joback Calculated Property |
| Cp,gas | 666.43 | J/mol×K | 762.80 | Joback Calculated Property |
| Cp,gas | 681.73 | J/mol×K | 796.67 | Joback Calculated Property |
| Cp,gas | 696.09 | J/mol×K | 830.54 | Joback Calculated Property |
| Cp,gas | 709.54 | J/mol×K | 864.41 | Joback Calculated Property |
| Cp,gas | 722.14 | J/mol×K | 898.29 | Joback Calculated Property |
| η | [0.0000864; 0.0019547] | Pa×s | [359.85; 695.05] |
|
| η | 0.0019547 | Pa×s | 359.85 | Joback Calculated Property |
| η | 0.0008198 | Pa×s | 415.72 | Joback Calculated Property |
| η | 0.0004224 | Pa×s | 471.58 | Joback Calculated Property |
| η | 0.0002505 | Pa×s | 527.45 | Joback Calculated Property |
| η | 0.0001641 | Pa×s | 583.32 | Joback Calculated Property |
| η | 0.0001158 | Pa×s | 639.18 | Joback Calculated Property |
| η | 0.0000864 | Pa×s | 695.05 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Phenylpropionic acid, oct-3-en-2-yl ester.
Sources
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