- InChI
- InChI=1S/C22H44O3/c1-3-5-7-9-11-13-15-17-19-21-25-22(23)24-20-18-16-14-12-10-8-6-4-2/h3-21H2,1-2H3
- InChI Key
- AZZJAURDOGITTE-UHFFFAOYSA-N
- Formula
- C22H44O3
- SMILES
- CCCCCCCCCCCOC(=O)OCCCCCCCCCC
- Molecular Weight1
- 356.58
- 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 | 1.1016 | Relay (1.0) Calculated Property | |
| ΔfG° | -281.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -973.22 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 58.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 117.50 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.99 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.52 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.811 | Crippen Calculated Property | |
| McVol | 334.150 | ml/mol | McGowan Calculated Property |
| Pc | 895.34 | kPa | Joback Calculated Property |
| Inp | [2428.00; 2428.00] |
|
|
| Inp | 2428.00 | NIST | |
| Inp | 2428.00 | NIST | |
| Tboil | 619.55 | K | Relay (1.0) Calculated Property |
| Tc | 779.87 | K | Relay (1.0) Calculated Property |
| Tfus | 286.27 | K | Relay (1.0) Calculated Property |
| Vc | 1.327 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1054.79; 1161.98] | J/mol×K | [783.60; 960.43] |
|
| Cp,gas | 1054.79 | J/mol×K | 783.60 | Joback Calculated Property |
| Cp,gas | 1075.32 | J/mol×K | 813.07 | Joback Calculated Property |
| Cp,gas | 1094.75 | J/mol×K | 842.54 | Joback Calculated Property |
| Cp,gas | 1113.11 | J/mol×K | 872.01 | Joback Calculated Property |
| Cp,gas | 1130.42 | J/mol×K | 901.48 | Joback Calculated Property |
| Cp,gas | 1146.70 | J/mol×K | 930.95 | Joback Calculated Property |
| Cp,gas | 1161.98 | J/mol×K | 960.43 | Joback Calculated Property |
| η | [0.0000370; 0.0012277] | Pa×s | [402.26; 783.60] |
|
| η | 0.0012277 | Pa×s | 402.26 | Joback Calculated Property |
| η | 0.0004601 | Pa×s | 465.82 | Joback Calculated Property |
| η | 0.0002182 | Pa×s | 529.37 | Joback Calculated Property |
| η | 0.0001215 | Pa×s | 592.93 | Joback Calculated Property |
| η | 0.0000757 | Pa×s | 656.49 | Joback Calculated Property |
| η | 0.0000513 | Pa×s | 720.04 | Joback Calculated Property |
| η | 0.0000370 | Pa×s | 783.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, decyl undecyl ester.
Sources
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