- InChI
- InChI=1S/C19H36O/c1-4-5-6-7-8-9-10-11-15-18-19(20-18)16-13-12-14-17(2)3/h7-8,17-19H,4-6,9-16H2,1-3H3/b8-7+
- InChI Key
- MUBMRTHAAOPMIY-BQYQJAHWSA-N
- Formula
- C19H36O
- SMILES
- CCCCC=CCCCCC1OC1CCCCC(C)C
- Molecular Weight1
- 280.49
- 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 | 0.6934 | Relay (1.0) Calculated Property | |
| ΔfG° | 153.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -432.92 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 48.83 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.94 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.43 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.277 | Crippen Calculated Property | |
| McVol | 269.280 | ml/mol | McGowan Calculated Property |
| Pc | 1194.00 | kPa | Joback Calculated Property |
| Inp | [2017.00; 2017.00] |
|
|
| Inp | 2017.00 | NIST | |
| Inp | 2017.00 | NIST | |
| Tboil | 588.93 | K | Relay (1.0) Calculated Property |
| Tc | 762.41 | K | Relay (1.0) Calculated Property |
| Tfus | 268.29 | K | Relay (1.0) Calculated Property |
| Vc | 1.019 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [390.41; 975.43] | 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 | -5.72290e+01 | |||
| Coefficient B | 1.95616e+00 | |||
| Coefficient C | -1.24770e-03 | |||
| Coefficient D | 3.24200e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 390.41 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 493.01 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 583.82 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 663.86 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 734.17 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 795.75 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 849.64 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 896.87 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 938.46 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 975.43 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0030466; 0.0003412] | Pa×s | [324.08; 589.20] |
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 | -1.06594e+01 | |||
| Coefficient B | 1.57688e+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. | 324.08 | |||
| Temperature range, max. | 589.20 | |||
| η | 0.0030466 | Pa×s | 324.08 | Calculated Property |
| η | 0.0020311 | Pa×s | 353.54 | Calculated Property |
| η | 0.0014413 | Pa×s | 383.00 | Calculated Property |
| η | 0.0010741 | Pa×s | 412.45 | Calculated Property |
| η | 0.0008325 | Pa×s | 441.91 | Calculated Property |
| η | 0.0006661 | Pa×s | 471.37 | Calculated Property |
| η | 0.0005471 | Pa×s | 500.83 | Calculated Property |
| η | 0.0004593 | Pa×s | 530.28 | Calculated Property |
| η | 0.0003928 | Pa×s | 559.74 | Calculated Property |
| η | 0.0003412 | Pa×s | 589.20 | Calculated Property |
Similar Compounds
Find more compounds similar to cis-7,8-epoxy-2-methyl-E13-octadecene.
Sources
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