- InChI
- InChI=1S/C17H32/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-4H,1-2,5-17H2
- InChI Key
- LGYMYODKHKZIEU-UHFFFAOYSA-N
- Formula
- C17H32
- SMILES
- C=CCCCCCCCCCCCCCC=C
- Molecular Weight1
- 236.44
- 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 | 0.7031 | Relay (1.0) Calculated Property | |
| ΔfG° | 267.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -205.03 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 37.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.52 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.34 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.13 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.430 | Crippen Calculated Property | |
| McVol | 241.790 | ml/mol | McGowan Calculated Property |
| Pc | 1307.06 | kPa | Joback Calculated Property |
| Inp | [1679.00; 1682.00] |
|
|
| Inp | 1679.00 | NIST | |
| Inp | 1679.00 | NIST | |
| Inp | 1682.00 | NIST | |
| Ip | 1799.00 | NIST | |
| Tboil | 565.44 | K | Relay (1.0) Calculated Property |
| Tc | 730.25 | K | Relay (1.0) Calculated Property |
| Tfus | 285.03 | K | Relay (1.0) Calculated Property |
| Vc | 0.929 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [346.50; 839.35] | 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 | -1.85470e+01 | |||
| Coefficient B | 1.57880e+00 | |||
| Coefficient C | -9.46800e-04 | |||
| Coefficient D | 2.25900e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 346.50 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 431.50 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 507.27 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 574.54 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 634.00 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 686.38 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 732.39 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 772.75 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 808.16 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 839.35 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0041882; 0.0002098] | Pa×s | [277.83; 521.36] |
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 | -1.18853e+01 | |||
| Coefficient B | 1.78084e+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. | 277.83 | |||
| Temperature range, max. | 521.36 | |||
| η | 0.0041882 | Pa×s | 277.83 | Calculated Property |
| η | 0.0023712 | Pa×s | 304.89 | Calculated Property |
| η | 0.0014730 | Pa×s | 331.95 | Calculated Property |
| η | 0.0009831 | Pa×s | 359.01 | Calculated Property |
| η | 0.0006944 | Pa×s | 386.07 | Calculated Property |
| η | 0.0005133 | Pa×s | 413.12 | Calculated Property |
| η | 0.0003938 | Pa×s | 440.18 | Calculated Property |
| η | 0.0003116 | Pa×s | 467.24 | Calculated Property |
| η | 0.0002529 | Pa×s | 494.30 | Calculated Property |
| η | 0.0002098 | Pa×s | 521.36 | Calculated Property |
Similar Compounds
Find more compounds similar to heptadecadiene-1,16.
Sources
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