- InChI
- InChI=1S/C11H20/c1-3-5-7-9-11-10-8-6-4-2/h3,5-6,8H,4,7,9-11H2,1-2H3/b5-3+,8-6+
- InChI Key
- HVQCNZHALHTAOX-QFXXITGJSA-N
- Formula
- C11H20
- SMILES
- C/C=C/CCCC/C=C/CC
- Molecular Weight1
- 152.28
- 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 | 0.3831 | Relay (1.0) Calculated Property | |
| ΔfG° | 202.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -85.80 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 24.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.65 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.56 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.089 | Crippen Calculated Property | |
| McVol | 157.250 | ml/mol | McGowan Calculated Property |
| Pc | 2123.64 | kPa | Joback Calculated Property |
| Inp | [995.40; 995.40] |
|
|
| Inp | 995.40 | NIST | |
| Inp | 995.40 | NIST | |
| Tboil | 456.66 | K | Relay (1.0) Calculated Property |
| Tc | 641.21 | K | Relay (1.0) Calculated Property |
| Tfus | 214.47 | K | Relay (1.0) Calculated Property |
| Vc | 0.579 | 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 | [210.83; 525.66] | 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 | -3.54750e+01 | |||
| Coefficient B | 1.08884e+00 | |||
| Coefficient C | -7.42200e-04 | |||
| Coefficient D | 2.14500e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 210.83 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 266.34 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 315.13 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 357.89 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 395.29 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 428.01 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 456.73 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 482.13 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 504.88 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 525.66 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0055290; 0.0001728] | Pa×s | [203.57; 445.71] |
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 | -1.15773e+01 | |||
| Coefficient B | 1.29868e+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. | 203.57 | |||
| Temperature range, max. | 445.71 | |||
| η | 0.0055290 | Pa×s | 203.57 | Calculated Property |
| η | 0.0026256 | Pa×s | 230.47 | Calculated Property |
| η | 0.0014569 | Pa×s | 257.38 | Calculated Property |
| η | 0.0009037 | Pa×s | 284.28 | Calculated Property |
| η | 0.0006088 | Pa×s | 311.19 | Calculated Property |
| η | 0.0004368 | Pa×s | 338.09 | Calculated Property |
| η | 0.0003291 | Pa×s | 364.99 | Calculated Property |
| η | 0.0002578 | Pa×s | 391.90 | Calculated Property |
| η | 0.0002083 | Pa×s | 418.80 | Calculated Property |
| η | 0.0001728 | Pa×s | 445.71 | Calculated Property |
Similar Compounds
Find more compounds similar to trans-2,trans-8-decadiene.
Sources
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