- InChI
- InChI=1S/C28H58/c1-8-9-10-16-25(4)18-12-20-27(6)22-14-23-28(7)21-13-19-26(5)17-11-15-24(2)3/h24-28H,8-23H2,1-7H3
- InChI Key
- HVOSWHGKDMEVNU-UHFFFAOYSA-N
- Formula
- C28H58
- SMILES
-
CCCCCC(C)CCCC(C)CCCC(C)CCCC(C)
CCCC(C)C - Molecular Weight1
- 394.76
- 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 | 0.9417 | Relay (1.0) Calculated Property | |
| ΔfG° | 172.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -726.60 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 50.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 119.72 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.69 | eV | Relay (1.0) Calculated Property |
| log10WS | -10.47 | Relay (1.0) Calculated Property | |
| logPoct/wat | 10.448 | Crippen Calculated Property | |
| McVol | 405.380 | ml/mol | McGowan Calculated Property |
| Pc | 669.08 | kPa | Joback Calculated Property |
| Inp | [2470.00; 2470.00] |
|
|
| Inp | 2470.00 | NIST | |
| Inp | 2470.00 | NIST | |
| Inp | 2470.00 | NIST | |
| Inp | 2470.00 | NIST | |
| Inp | 2470.00 | NIST | |
| Tboil | 633.67 | K | Relay (1.0) Calculated Property |
| Tc | 798.67 | K | Relay (1.0) Calculated Property |
| Tfus | 229.98 | K | Relay (1.0) Calculated Property |
| Vc | 1.544 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [597.89; 1466.57] | 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 | -3.09740e+01 | |||
| Coefficient B | 2.69344e+00 | |||
| Coefficient C | -1.51540e-03 | |||
| Coefficient D | 3.19500e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 597.89 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 746.39 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 879.53 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 998.33 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 1103.80 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1196.95 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1278.79 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1350.33 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1412.59 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1466.57 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0066589; 0.0000395] | Pa×s | [330.32; 718.20] |
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 | -1.45057e+01 | |||
| Coefficient B | 3.13602e+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. | 330.32 | |||
| Temperature range, max. | 718.20 | |||
| η | 0.0066589 | Pa×s | 330.32 | Calculated Property |
| η | 0.0022260 | Pa×s | 373.42 | Calculated Property |
| η | 0.0009336 | Pa×s | 416.52 | Calculated Property |
| η | 0.0004608 | Pa×s | 459.61 | Calculated Property |
| η | 0.0002567 | Pa×s | 502.71 | Calculated Property |
| η | 0.0001569 | Pa×s | 545.81 | Calculated Property |
| η | 0.0001030 | Pa×s | 588.91 | Calculated Property |
| η | 0.0000717 | Pa×s | 632.00 | Calculated Property |
| η | 0.0000522 | Pa×s | 675.10 | Calculated Property |
| η | 0.0000395 | Pa×s | 718.20 | Calculated Property |
Similar Compounds
Find more compounds similar to Tricosane, 2,6,10,14,18-pentamethyl.
Sources
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