- InChI
- InChI=1S/C19H36O2/c1-2-3-4-5-6-7-8-9-12-17-21-19(20)16-15-18-13-10-11-14-18/h18H,2-17H2,1H3
- InChI Key
- PCABZFXNXVVEDP-UHFFFAOYSA-N
- Formula
- C19H36O2
- SMILES
- CCCCCCCCCCCOC(=O)CCC1CCCC1
- Molecular Weight1
- 296.49
- 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.
- 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 | 0.8480 | Relay (1.0) Calculated Property | |
| ΔfG° | -164.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -715.76 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 43.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.23 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.56 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.031 | Crippen Calculated Property | |
| McVol | 275.150 | ml/mol | McGowan Calculated Property |
| Pc | 1225.12 | kPa | Joback Calculated Property |
| Inp | 2165.90 | NIST | |
| Tboil | 612.42 | K | Relay (1.0) Calculated Property |
| Tc | 804.99 | K | Relay (1.0) Calculated Property |
| Tfus | 258.99 | K | Relay (1.0) Calculated Property |
| Vc | 1.040 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [832.91; 941.22] | J/mol×K | [707.82; 888.28] | 
|
| Cp,gas | 832.91 | J/mol×K | 707.82 | Joback Calculated Property |
| Cp,gas | 853.59 | J/mol×K | 737.90 | Joback Calculated Property |
| Cp,gas | 873.18 | J/mol×K | 767.97 | Joback Calculated Property |
| Cp,gas | 891.71 | J/mol×K | 798.05 | Joback Calculated Property |
| Cp,gas | 909.20 | J/mol×K | 828.13 | Joback Calculated Property |
| Cp,gas | 925.70 | J/mol×K | 858.21 | Joback Calculated Property |
| Cp,gas | 941.22 | J/mol×K | 888.28 | Joback Calculated Property |
| η | [0.0001080; 0.0030177] | Pa×s | [357.12; 707.82] |
|
| η | 0.0030177 | Pa×s | 357.12 | Joback Calculated Property |
| η | 0.0011726 | Pa×s | 415.57 | Joback Calculated Property |
| η | 0.0005753 | Pa×s | 474.02 | Joback Calculated Property |
| η | 0.0003300 | Pa×s | 532.47 | Joback Calculated Property |
| η | 0.0002113 | Pa×s | 590.92 | Joback Calculated Property |
| η | 0.0001466 | Pa×s | 649.37 | Joback Calculated Property |
| η | 0.0001080 | Pa×s | 707.82 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Cyclopentylpropionic acid, undecyl ester.
Sources
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