- InChI
- InChI=1S/C24H48O3/c1-3-5-7-9-11-13-14-15-17-19-21-23-27-24(25)26-22-20-18-16-12-10-8-6-4-2/h3-23H2,1-2H3
- InChI Key
- PEHNMRQCEFCHOD-UHFFFAOYSA-N
- Formula
- C24H48O3
- SMILES
- CCCCCCCCCCCCCOC(=O)OCCCCCCCCCC
- Molecular Weight1
- 384.64
- 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 | 1.1717 | Relay (1.0) Calculated Property | |
| ΔfG° | -264.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1013.43 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 63.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 125.70 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.05 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.14 | Relay (1.0) Calculated Property | |
| logPoct/wat | 8.591 | Crippen Calculated Property | |
| McVol | 362.330 | ml/mol | McGowan Calculated Property |
| Pc | 800.69 | kPa | Joback Calculated Property |
| Inp | [2616.00; 2616.00] |
|
|
| Inp | 2616.00 | NIST | |
| Inp | 2616.00 | NIST | |
| Tboil | 632.68 | K | Relay (1.0) Calculated Property |
| Tc | 794.42 | K | Relay (1.0) Calculated Property |
| Tfus | 294.46 | K | Relay (1.0) Calculated Property |
| Vc | 1.439 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [546.35; 1284.12] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 3.19810e+01 | |||
| Coefficient B | 2.16584e+00 | |||
| Coefficient C | -1.07620e-03 | |||
| Coefficient D | 1.62500e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 546.35 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 670.71 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 783.27 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 884.54 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 975.06 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1055.32 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1125.84 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1187.14 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1239.73 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1284.12 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0009460; 0.0000511] | Pa×s | [424.80; 710.81] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.42187e+01 | |||
| Coefficient B | 3.08209e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 424.80 | |||
| Temperature range, max. | 710.81 | |||
| η | 0.0009460 | Pa×s | 424.80 | Calculated Property |
| η | 0.0005709 | Pa×s | 456.58 | Calculated Property |
| η | 0.0003680 | Pa×s | 488.36 | Calculated Property |
| η | 0.0002502 | Pa×s | 520.14 | Calculated Property |
| η | 0.0001779 | Pa×s | 551.91 | Calculated Property |
| η | 0.0001313 | Pa×s | 583.69 | Calculated Property |
| η | 0.0000999 | Pa×s | 615.47 | Calculated Property |
| η | 0.0000782 | Pa×s | 647.25 | Calculated Property |
| η | 0.0000625 | Pa×s | 679.03 | Calculated Property |
| η | 0.0000511 | Pa×s | 710.81 | Calculated Property |
Similar Compounds
Find more compounds similar to Carbonic acid, decyl tridecyl ester.
Sources
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