- 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° | -162.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1074.03 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 69.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 136.22 | 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 | 699.50 | 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 | 810.88 | K | Relay (1.0) Calculated Property |
| Tfus | 308.12 | K | Relay (1.0) Calculated Property |
| Vc | 1.603 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1384.92; 1502.75] | J/mol×K | [915.87; 1128.23] |
|
| Cp,gas | 1384.92 | J/mol×K | 915.87 | Joback Calculated Property |
| Cp,gas | 1408.51 | J/mol×K | 951.26 | Joback Calculated Property |
| Cp,gas | 1430.45 | J/mol×K | 986.66 | Joback Calculated Property |
| Cp,gas | 1450.79 | J/mol×K | 1022.05 | Joback Calculated Property |
| Cp,gas | 1469.59 | J/mol×K | 1057.44 | Joback Calculated Property |
| Cp,gas | 1486.89 | J/mol×K | 1092.83 | Joback Calculated Property |
| Cp,gas | 1502.75 | J/mol×K | 1128.23 | Joback Calculated Property |
| η | [0.0000198; 0.0004821] | Pa×s | [488.44; 915.87] |
|
| η | 0.0004821 | Pa×s | 488.44 | Joback Calculated Property |
| η | 0.0002017 | Pa×s | 559.68 | Joback Calculated Property |
| η | 0.0001028 | Pa×s | 630.92 | Joback Calculated Property |
| η | 0.0000600 | Pa×s | 702.15 | Joback Calculated Property |
| η | 0.0000387 | Pa×s | 773.39 | Joback Calculated Property |
| η | 0.0000269 | Pa×s | 844.63 | Joback Calculated Property |
| η | 0.0000198 | Pa×s | 915.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, decyl hexadecyl ester.
Sources
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