- InChI
- InChI=1S/C25H50/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2/h17,19H,3-16,18,20-25H2,1-2H3/b19-17-
- InChI Key
- YJTCMKZGFBOKQS-ZPHPHTNESA-N
- Formula
- C25H50
- SMILES
- CCCCCCCC/C=C\CCCCCCCCCCCCCCC
- Molecular Weight1
- 350.67
- 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.
- Ip : 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 | 0.9679 | Relay (1.0) Calculated Property | |
| ΔfG° | 239.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -469.95 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 60.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 125.25 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.22 | eV | Relay (1.0) Calculated Property |
| log10WS | -9.49 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.775 | Crippen Calculated Property | |
| McVol | 358.810 | ml/mol | McGowan Calculated Property |
| Pc | 786.39 | kPa | Joback Calculated Property |
| Inp | [2470.00; 2473.00] |
|
|
| Inp | 2473.00 | NIST | |
| Inp | 2470.00 | NIST | |
| Inp | 2473.00 | NIST | |
| Ip | 2519.00 | NIST | |
| Tboil | 604.27 | K | Relay (1.0) Calculated Property |
| Tc | 790.16 | K | Relay (1.0) Calculated Property |
| Tfus | 279.49 | K | Relay (1.0) Calculated Property |
| Vc | 1.418 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [521.82; 1278.52] | 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 | -3.40190e+01 | |||
| Coefficient B | 2.39884e+00 | |||
| Coefficient C | -1.42000e-03 | |||
| Coefficient D | 3.33700e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 521.82 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 651.69 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 767.64 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 870.74 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 962.05 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1042.61 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1113.48 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1175.72 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1230.38 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1278.52 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0019564; 0.0000767] | Pa×s | [366.43; 665.64] |
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 | -1.34431e+01 | |||
| Coefficient B | 2.64068e+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. | 366.43 | |||
| Temperature range, max. | 665.64 | |||
| η | 0.0019564 | Pa×s | 366.43 | Calculated Property |
| η | 0.0010743 | Pa×s | 399.68 | Calculated Property |
| η | 0.0006468 | Pa×s | 432.92 | Calculated Property |
| η | 0.0004187 | Pa×s | 466.17 | Calculated Property |
| η | 0.0002871 | Pa×s | 499.41 | Calculated Property |
| η | 0.0002064 | Pa×s | 532.66 | Calculated Property |
| η | 0.0001543 | Pa×s | 565.90 | Calculated Property |
| η | 0.0001191 | Pa×s | 599.15 | Calculated Property |
| η | 0.0000945 | Pa×s | 632.39 | Calculated Property |
| η | 0.0000767 | Pa×s | 665.64 | Calculated Property |
Similar Compounds
Find more compounds similar to (Z)-9-pentacosene.
Sources
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