- InChI
- InChI=1S/C25H48/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/h11,13,17,19H,3-10,12,14-16,18,20-25H2,1-2H3/b13-11+,19-17+
- InChI Key
- HEDSUJXTHUJEDT-GRAPOSQESA-N
- Formula
- C25H48
- SMILES
-
CCCCC/C=C/C/C=C/CCCCCCCCCCCCCC
C - Molecular Weight1
- 348.66
- 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 | 0.8830 | Relay (1.0) Calculated Property | |
| ΔfG° | 320.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -375.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 60.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 123.34 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.05 | eV | Relay (1.0) Calculated Property |
| log10WS | -9.42 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.550 | Crippen Calculated Property | |
| McVol | 354.510 | ml/mol | McGowan Calculated Property |
| Pc | 809.83 | kPa | Joback Calculated Property |
| Inp | 2453.00 | NIST | |
| Tboil | 609.08 | K | Relay (1.0) Calculated Property |
| Tc | 790.76 | K | Relay (1.0) Calculated Property |
| Tfus | 280.24 | K | Relay (1.0) Calculated Property |
| Vc | 1.356 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [507.82; 1247.94] | 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 | -4.82010e+01 | |||
| Coefficient B | 2.41884e+00 | |||
| Coefficient C | -1.50380e-03 | |||
| Coefficient D | 3.81100e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 507.82 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 636.19 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 750.22 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 851.10 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 940.05 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1018.27 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1086.96 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1147.33 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1200.59 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1247.94 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0018495; 0.0000658] | Pa×s | [361.35; 669.95] |
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 | -1.35349e+01 | |||
| Coefficient B | 2.61692e+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. | 361.35 | |||
| Temperature range, max. | 669.95 | |||
| η | 0.0018495 | Pa×s | 361.35 | Calculated Property |
| η | 0.0009873 | Pa×s | 395.64 | Calculated Property |
| η | 0.0005826 | Pa×s | 429.93 | Calculated Property |
| η | 0.0003716 | Pa×s | 464.22 | Calculated Property |
| η | 0.0002522 | Pa×s | 498.50 | Calculated Property |
| η | 0.0001799 | Pa×s | 532.79 | Calculated Property |
| η | 0.0001337 | Pa×s | 567.08 | Calculated Property |
| η | 0.0001027 | Pa×s | 601.37 | Calculated Property |
| η | 0.0000812 | Pa×s | 635.66 | Calculated Property |
| η | 0.0000658 | Pa×s | 669.95 | Calculated Property |
Similar Compounds
Find more compounds similar to 6,9-Pentacosadiene.
Sources
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