- InChI
- InChI=1S/C28H46O5/c1-2-3-4-5-6-9-12-18-23-32-27(29)21-16-10-7-8-11-17-22-28(30)33-25-24-31-26-19-14-13-15-20-26/h13-15,19-20H,2-12,16-18,21-25H2,1H3
- InChI Key
- AETIFEAXOVXOHJ-UHFFFAOYSA-N
- Formula
- C28H46O5
- SMILES
-
CCCCCCCCCCOC(=O)CCCCCCCCC(=O)O
CCOc1ccccc1 - Molecular Weight1
- 462.66
- 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° | -275.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1006.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 69.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.92 | kJ/mol | Joback Calculated Property |
| log10WS | -8.11 | Crippen Calculated Property | |
| logPoct/wat | 7.413 | Crippen Calculated Property | |
| McVol | 402.370 | ml/mol | McGowan Calculated Property |
| Pc | 816.33 | kPa | Joback Calculated Property |
| Inp | [3332.00; 3332.00] |
|
|
| Inp | 3332.00 | NIST | |
| Inp | 3332.00 | NIST | |
| Tboil | 1041.72 | K | Joback Calculated Property |
| Tc | 1283.59 | K | Joback Calculated Property |
| Tfus | 598.29 | K | Joback Calculated Property |
| Vc | 1.562 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1399.19; 1474.92] | J/mol×K | [1041.72; 1283.59] |
|
| Cp,gas | 1399.19 | J/mol×K | 1041.72 | Joback Calculated Property |
| Cp,gas | 1416.67 | J/mol×K | 1082.03 | Joback Calculated Property |
| Cp,gas | 1432.12 | J/mol×K | 1122.34 | Joback Calculated Property |
| Cp,gas | 1445.60 | J/mol×K | 1162.66 | Joback Calculated Property |
| Cp,gas | 1457.19 | J/mol×K | 1202.97 | Joback Calculated Property |
| Cp,gas | 1466.94 | J/mol×K | 1243.28 | Joback Calculated Property |
| Cp,gas | 1474.92 | J/mol×K | 1283.59 | Joback Calculated Property |
| η | [0.0000119; 0.0001833] | Pa×s | [598.29; 1041.72] |
|
| η | 0.0001833 | Pa×s | 598.29 | Joback Calculated Property |
| η | 0.0000905 | Pa×s | 672.19 | Joback Calculated Property |
| η | 0.0000514 | Pa×s | 746.10 | Joback Calculated Property |
| η | 0.0000323 | Pa×s | 820.00 | Joback Calculated Property |
| η | 0.0000220 | Pa×s | 893.91 | Joback Calculated Property |
| η | 0.0000158 | Pa×s | 967.81 | Joback Calculated Property |
| η | 0.0000119 | Pa×s | 1041.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Sebacic acid, decyl 2-phenoxyethyl ester.
Sources
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