- InChI
- InChI=1S/C27H54O3/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-26-30-27(28)29-25-23-21-19-12-10-8-6-4-2/h3-26H2,1-2H3
- InChI Key
- MMJXTJZQLOLBPO-UHFFFAOYSA-N
- Formula
- C27H54O3
- SMILES
-
CCCCCCCCCCCCCCCCOC(=O)OCCCCCCC
CCC - Molecular Weight1
- 426.72
- 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 | 1.2768 | Relay (1.0) Calculated Property | |
| ΔfG° | -238.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1074.03 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 71.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 137.86 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.14 | eV | Relay (1.0) Calculated Property |
| log10WS | -9.00 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.762 | Crippen Calculated Property | |
| McVol | 404.600 | ml/mol | McGowan Calculated Property |
| Pc | 684.57 | kPa | Joback Calculated Property |
| Inp | [2912.00; 2912.00] |
|
|
| Inp | 2912.00 | NIST | |
| Inp | 2912.00 | NIST | |
| Tboil | 652.05 | K | Relay (1.0) Calculated Property |
| Tc | 814.32 | K | Relay (1.0) Calculated Property |
| Tfus | 303.86 | K | Relay (1.0) Calculated Property |
| Vc | 1.604 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1374.18; 1491.50] | J/mol×K | [898.00; 1104.98] |
|
| Cp,gas | 1374.18 | J/mol×K | 898.00 | Joback Calculated Property |
| Cp,gas | 1397.64 | J/mol×K | 932.50 | Joback Calculated Property |
| Cp,gas | 1419.48 | J/mol×K | 966.99 | Joback Calculated Property |
| Cp,gas | 1439.74 | J/mol×K | 1001.49 | Joback Calculated Property |
| Cp,gas | 1458.46 | J/mol×K | 1035.99 | Joback Calculated Property |
| Cp,gas | 1475.70 | J/mol×K | 1070.48 | Joback Calculated Property |
| Cp,gas | 1491.50 | J/mol×K | 1104.98 | Joback Calculated Property |
| η | [0.0000173; 0.0006265] | Pa×s | [458.61; 898.00] |
|
| η | 0.0006265 | Pa×s | 458.61 | Joback Calculated Property |
| η | 0.0002281 | Pa×s | 531.84 | Joback Calculated Property |
| η | 0.0001061 | Pa×s | 605.07 | Joback Calculated Property |
| η | 0.0000582 | Pa×s | 678.31 | Joback Calculated Property |
| η | 0.0000359 | Pa×s | 751.54 | Joback Calculated Property |
| η | 0.0000241 | Pa×s | 824.77 | Joback Calculated Property |
| η | 0.0000173 | Pa×s | 898.00 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, decyl hexadecyl ester.
Sources
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