- InChI
- InChI=1S/C18H20O2/c19-18(12-9-14-5-1-2-6-14)20-17-11-10-15-7-3-4-8-16(15)13-17/h3-4,7-8,10-11,13-14H,1-2,5-6,9,12H2
- InChI Key
- AWDSCFKWFVOHGC-UHFFFAOYSA-N
- Formula
- C18H20O2
- SMILES
- O=C(CCC1CCCC1)Oc1ccc2ccccc2c1
- Molecular Weight1
- 268.35
- 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° | 112.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -183.04 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.65 | kJ/mol | Joback Calculated Property |
| log10WS | -5.75 | Crippen Calculated Property | |
| logPoct/wat | 4.716 | Crippen Calculated Property | |
| McVol | 217.840 | ml/mol | McGowan Calculated Property |
| Pc | 2145.33 | kPa | Joback Calculated Property |
| Inp | 2298.00 | NIST | |
| Tboil | 753.45 | K | Joback Calculated Property |
| Tc | 990.80 | K | Joback Calculated Property |
| Tfus | 447.32 | K | Joback Calculated Property |
| Vc | 0.823 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [635.60; 723.78] | J/mol×K | [753.45; 990.80] | 
|
| Cp,gas | 635.60 | J/mol×K | 753.45 | Joback Calculated Property |
| Cp,gas | 653.37 | J/mol×K | 793.01 | Joback Calculated Property |
| Cp,gas | 669.79 | J/mol×K | 832.57 | Joback Calculated Property |
| Cp,gas | 684.94 | J/mol×K | 872.12 | Joback Calculated Property |
| Cp,gas | 698.93 | J/mol×K | 911.68 | Joback Calculated Property |
| Cp,gas | 711.84 | J/mol×K | 951.24 | Joback Calculated Property |
| Cp,gas | 723.78 | J/mol×K | 990.80 | Joback Calculated Property |
| η | [0.0002615; 0.0015637] | Pa×s | [447.32; 753.45] |
|
| η | 0.0015637 | Pa×s | 447.32 | Joback Calculated Property |
| η | 0.0009964 | Pa×s | 498.34 | Joback Calculated Property |
| η | 0.0006903 | Pa×s | 549.36 | Joback Calculated Property |
| η | 0.0005091 | Pa×s | 600.38 | Joback Calculated Property |
| η | 0.0003937 | Pa×s | 651.41 | Joback Calculated Property |
| η | 0.0003161 | Pa×s | 702.43 | Joback Calculated Property |
| η | 0.0002615 | Pa×s | 753.45 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Cyclopentylpropionic acid, 2-naphthyl ester.
Sources
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