- InChI
- InChI=1S/C22H42O2/c1-3-5-6-7-8-9-10-11-12-13-19-21(16-4-2)24-22(23)20-17-14-15-18-20/h20-21H,3-19H2,1-2H3
- InChI Key
- FBBOXFRALFYLMY-UHFFFAOYSA-N
- Formula
- C22H42O2
- SMILES
-
CCCCCCCCCCCCC(CCC)OC(=O)C1CCCC
1 - Molecular Weight1
- 338.57
- 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° | -65.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -687.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.59 | kJ/mol | Joback Calculated Property |
| log10WS | -7.66 | Crippen Calculated Property | |
| logPoct/wat | 7.200 | Crippen Calculated Property | |
| McVol | 317.420 | ml/mol | McGowan Calculated Property |
| Pc | 1043.27 | kPa | Joback Calculated Property |
| Inp | [285.10; 285.10] |
|
|
| Inp | 285.10 | NIST | |
| Inp | 285.10 | NIST | |
| Tboil | 793.89 | K | Joback Calculated Property |
| Tc | 980.66 | K | Joback Calculated Property |
| Tfus | 405.76 | K | Joback Calculated Property |
| Vc | 1.226 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1025.80; 1136.41] | J/mol×K | [793.89; 980.66] |
|
| Cp,gas | 1025.80 | J/mol×K | 793.89 | Joback Calculated Property |
| Cp,gas | 1047.08 | J/mol×K | 825.02 | Joback Calculated Property |
| Cp,gas | 1067.16 | J/mol×K | 856.15 | Joback Calculated Property |
| Cp,gas | 1086.10 | J/mol×K | 887.27 | Joback Calculated Property |
| Cp,gas | 1103.93 | J/mol×K | 918.40 | Joback Calculated Property |
| Cp,gas | 1120.68 | J/mol×K | 949.53 | Joback Calculated Property |
| Cp,gas | 1136.41 | J/mol×K | 980.66 | Joback Calculated Property |
| η | [0.0000754; 0.0019486] | Pa×s | [405.76; 793.89] |
|
| η | 0.0019486 | Pa×s | 405.76 | Joback Calculated Property |
| η | 0.0007807 | Pa×s | 470.45 | Joback Calculated Property |
| η | 0.0003902 | Pa×s | 535.14 | Joback Calculated Property |
| η | 0.0002265 | Pa×s | 599.83 | Joback Calculated Property |
| η | 0.0001462 | Pa×s | 664.51 | Joback Calculated Property |
| η | 0.0001020 | Pa×s | 729.20 | Joback Calculated Property |
| η | 0.0000754 | Pa×s | 793.89 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Hexadecyl cyclopentanecarboxylate.
Sources
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