- InChI
- InChI=1S/C16H32/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h11,13H,3-10,12,14-16H2,1-2H3/b13-11+
- InChI Key
- CTDXHTXAABMUIW-ACCUITESSA-N
- Formula
- C16H32
- SMILES
- CCCCCC=CCCCCCCCCC
- Molecular Weight1
- 224.43
- Other Names
-
- (E)-6-Hexadecene
- 6-Hexadecene, (E)
- 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.
- I : 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 | 0.6509 | Relay (1.0) Calculated Property | |
| ΔfG° | 164.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -301.27 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 37.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.36 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.86 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.12 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.264 | Crippen Calculated Property | |
| McVol | 232.000 | ml/mol | McGowan Calculated Property |
| Pc | 1369.71 | kPa | Joback Calculated Property |
| Inp | [1575.00; 1577.50] |
|
|
| Inp | 1576.60 | NIST | |
| Inp | 1577.50 | NIST | |
| Inp | 1575.00 | NIST | |
| Inp | 1575.00 | NIST | |
| I | [1610.70; 1611.00] |
|
|
| I | 1611.00 | NIST | |
| I | 1610.70 | NIST | |
| I | 1611.00 | NIST | |
| Tboil | 542.55 | K | Relay (1.0) Calculated Property |
| Tc | 715.29 | K | Relay (1.0) Calculated Property |
| Tfus | 253.59 | K | Relay (1.0) Calculated Property |
| Vc | 0.918 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [330.90; 814.20] | 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 | -2.58380e+01 | |||
| Coefficient B | 1.54384e+00 | |||
| Coefficient C | -9.30400e-04 | |||
| Coefficient D | 2.26600e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 330.90 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 413.92 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 487.95 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 553.68 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 611.85 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 663.16 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 708.33 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 748.09 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 783.14 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 814.20 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0048369; 0.0001824] | Pa×s | [265.00; 513.95] |
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 | -1.20984e+01 | |||
| Coefficient B | 1.79324e+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. | 265.00 | |||
| Temperature range, max. | 513.95 | |||
| η | 0.0048369 | Pa×s | 265.00 | Calculated Property |
| η | 0.0025515 | Pa×s | 292.66 | Calculated Property |
| η | 0.0015032 | Pa×s | 320.32 | Calculated Property |
| η | 0.0009633 | Pa×s | 347.98 | Calculated Property |
| η | 0.0006591 | Pa×s | 375.64 | Calculated Property |
| η | 0.0004751 | Pa×s | 403.31 | Calculated Property |
| η | 0.0003571 | Pa×s | 430.97 | Calculated Property |
| η | 0.0002779 | Pa×s | 458.63 | Calculated Property |
| η | 0.0002224 | Pa×s | 486.29 | Calculated Property |
| η | 0.0001824 | Pa×s | 513.95 | Calculated Property |
Similar Compounds
Find more compounds similar to trans-6-Hexadecene.
Sources
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