- InChI
- InChI=1S/C28H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-30-28(29)27-24-26(27)25-21-18-17-19-22-25/h17-19,21-22,26-27H,2-16,20,23-24H2,1H3
- InChI Key
- IEFIGJUOZNQAAS-UHFFFAOYSA-N
- Formula
- C28H46O2
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)C1CC1c
1ccccc1 - Molecular Weight1
- 414.66
- 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° | 116.41 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -577.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 64.31 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.96 | kJ/mol | Joback Calculated Property |
| log10WS | -9.13 | Crippen Calculated Property | |
| logPoct/wat | 8.595 | Crippen Calculated Property | |
| McVol | 378.200 | ml/mol | McGowan Calculated Property |
| Pc | 849.00 | kPa | Joback Calculated Property |
| Inp | [3184.00; 3184.00] |
|
|
| Inp | 3184.00 | NIST | |
| Inp | 3184.00 | NIST | |
| Tboil | 945.08 | K | Joback Calculated Property |
| Tc | 1157.05 | K | Joback Calculated Property |
| Tfus | 517.60 | K | Joback Calculated Property |
| Vc | 1.476 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1307.43; 1414.81] | J/mol×K | [945.08; 1157.05] |
|
| Cp,gas | 1307.43 | J/mol×K | 945.08 | Joback Calculated Property |
| Cp,gas | 1328.28 | J/mol×K | 980.41 | Joback Calculated Property |
| Cp,gas | 1347.82 | J/mol×K | 1015.74 | Joback Calculated Property |
| Cp,gas | 1366.14 | J/mol×K | 1051.07 | Joback Calculated Property |
| Cp,gas | 1383.36 | J/mol×K | 1086.40 | Joback Calculated Property |
| Cp,gas | 1399.55 | J/mol×K | 1121.72 | Joback Calculated Property |
| Cp,gas | 1414.81 | J/mol×K | 1157.05 | Joback Calculated Property |
| η | [0.0001040; 0.0009956] | Pa×s | [517.60; 945.08] |
|
| η | 0.0009956 | Pa×s | 517.60 | Joback Calculated Property |
| η | 0.0005441 | Pa×s | 588.85 | Joback Calculated Property |
| η | 0.0003387 | Pa×s | 660.09 | Joback Calculated Property |
| η | 0.0002313 | Pa×s | 731.34 | Joback Calculated Property |
| η | 0.0001690 | Pa×s | 802.59 | Joback Calculated Property |
| η | 0.0001300 | Pa×s | 873.83 | Joback Calculated Property |
| η | 0.0001040 | Pa×s | 945.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopropanecarboxylic acid, trans-2-phenyl-, octadecyl ester.
Sources
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