- InChI
- InChI=1S/C17H34/c1-7-9-14(3)11-16(5)13-17(6)12-15(4)10-8-2/h7,9,14-17H,8,10-13H2,1-6H3/b9-7+
- InChI Key
- VJUDBUXGIZBNEB-VQHVLOKHSA-N
- Formula
- C17H34
- SMILES
- CC=CC(C)CC(C)CC(C)CC(C)CCC
- Molecular Weight1
- 238.45
- 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).
- 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 | 0.5383 | Relay (1.0) Calculated Property | |
| ΔfG° | 162.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -380.68 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.13 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.89 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 6.077 | Crippen Calculated Property | |
| McVol | 246.090 | ml/mol | McGowan Calculated Property |
| Pc | 1307.06 | kPa | Joback Calculated Property |
| Inp | [1440.00; 1509.00] |
|
|
| Inp | 1440.00 | NIST | |
| Inp | 1509.00 | NIST | |
| Inp | 1440.00 | NIST | |
| Tboil | 530.99 | K | Relay (1.0) Calculated Property |
| Tc | 684.23 | K | Relay (1.0) Calculated Property |
| Tfus | 205.23 | K | Relay (1.0) Calculated Property |
| Vc | 0.877 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [350.85; 867.94] | 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 | -3.34750e+01 | |||
| Coefficient B | 1.66252e+00 | |||
| Coefficient C | -9.97600e-04 | |||
| Coefficient D | 2.36500e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 350.85 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 440.30 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 520.00 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 590.71 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 653.17 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 708.13 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 756.34 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 798.55 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 835.50 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 867.95 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0352161; 0.0001273] | Pa×s | [216.27; 535.94] |
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 | -1.27728e+01 | |||
| Coefficient B | 2.03868e+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. | 216.27 | |||
| Temperature range, max. | 535.94 | |||
| η | 0.0352161 | Pa×s | 216.27 | Calculated Property |
| η | 0.0093160 | Pa×s | 251.79 | Calculated Property |
| η | 0.0034238 | Pa×s | 287.31 | Calculated Property |
| η | 0.0015684 | Pa×s | 322.83 | Calculated Property |
| η | 0.0008387 | Pa×s | 358.35 | Calculated Property |
| η | 0.0005021 | Pa×s | 393.86 | Calculated Property |
| η | 0.0003272 | Pa×s | 429.38 | Calculated Property |
| η | 0.0002277 | Pa×s | 464.90 | Calculated Property |
| η | 0.0001668 | Pa×s | 500.42 | Calculated Property |
| η | 0.0001273 | Pa×s | 535.94 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Tridecene, 4,6,8,10-tetramethyl.
Sources
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