- InChI
- InChI=1S/C23H44O2/c1-3-5-7-9-10-11-12-13-14-16-18-20-23(25)21-22(24)19-17-15-8-6-4-2/h3-21H2,1-2H3
- InChI Key
- OSMNRTXYXSSFOW-UHFFFAOYSA-N
- Formula
- C23H44O2
- SMILES
-
CCCCCCCCCCCCCC(=O)CC(=O)CCCCCC
C - Molecular Weight1
- 352.60
- 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 | 1.0228 | Relay (1.0) Calculated Property | |
| ΔfG° | -115.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -775.44 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 58.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 104.80 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.11 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.57 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.576 | Crippen Calculated Property | |
| McVol | 338.070 | ml/mol | McGowan Calculated Property |
| Pc | 918.27 | kPa | Joback Calculated Property |
| Inp | [2571.40; 2571.40] |
|
|
| Inp | 2571.40 | NIST | |
| Inp | 2571.40 | NIST | |
| Tboil | 616.64 | K | Relay (1.0) Calculated Property |
| Tc | 820.67 | K | Relay (1.0) Calculated Property |
| Tfus | 345.23 | K | Relay (1.0) Calculated Property |
| Vc | 1.297 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [495.25; 1183.96] | 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 | -3.30100e+00 | |||
| Coefficient B | 2.13284e+00 | |||
| Coefficient C | -1.19000e-03 | |||
| Coefficient D | 2.44420e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 495.25 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 613.13 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 718.88 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 813.25 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 897.02 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 970.97 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1035.86 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1092.48 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1141.58 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1183.96 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0013047; 0.0001114] | Pa×s | [448.83; 714.70] |
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 | -1.32557e+01 | |||
| Coefficient B | 2.96850e+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. | 448.83 | |||
| Temperature range, max. | 714.70 | |||
| η | 0.0013047 | Pa×s | 448.83 | Calculated Property |
| η | 0.0008672 | Pa×s | 478.37 | Calculated Property |
| η | 0.0006045 | Pa×s | 507.91 | Calculated Property |
| η | 0.0004384 | Pa×s | 537.45 | Calculated Property |
| η | 0.0003288 | Pa×s | 566.99 | Calculated Property |
| η | 0.0002537 | Pa×s | 596.53 | Calculated Property |
| η | 0.0002006 | Pa×s | 626.08 | Calculated Property |
| η | 0.0001620 | Pa×s | 655.62 | Calculated Property |
| η | 0.0001333 | Pa×s | 685.16 | Calculated Property |
| η | 0.0001114 | Pa×s | 714.70 | Calculated Property |
Similar Compounds
Find more compounds similar to Tricosane-8,10-dione.
Sources
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