- InChI
- InChI=1S/C10H18O/c1-2-3-4-5-6-7-8-9-10-11/h3-4,6-7,11H,2,5,8-10H2,1H3/b4-3-,7-6+
- InChI Key
- NKODDQZVUPANMP-WWVFNRLHSA-N
- Formula
- C10H18O
- SMILES
- CCC=CCC=CCCCO
- Molecular Weight1
- 154.25
- 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).
- 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 | 0.6156 | Relay (1.0) Calculated Property | |
| ΔfG° | 56.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -257.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 26.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.05 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.88 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 2.671 | Crippen Calculated Property | |
| McVol | 149.030 | ml/mol | McGowan Calculated Property |
| Pc | 2545.61 | kPa | Joback Calculated Property |
| Ip | 1862.00 | NIST | |
| Tboil | 504.42 | K | Relay (1.0) Calculated Property |
| Tc | 686.76 | K | Relay (1.0) Calculated Property |
| Tfus | 244.31 | K | Relay (1.0) Calculated Property |
| Vc | 0.520 | 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 | [202.11; 492.75] | 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 | -2.92750e+01 | |||
| Coefficient B | 1.02782e+00 | |||
| Coefficient C | -7.18200e-04 | |||
| Coefficient D | 2.12400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 202.11 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 253.86 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 299.18 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 338.73 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 373.20 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 403.25 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 429.56 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 452.80 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 473.64 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 492.74 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0350795; 0.0001313] | Pa×s | [253.12; 490.24] |
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 | -1.49024e+01 | |||
| Coefficient B | 2.92411e+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. | 253.12 | |||
| Temperature range, max. | 490.24 | |||
| η | 0.0350795 | Pa×s | 253.12 | Calculated Property |
| η | 0.0118051 | Pa×s | 279.47 | Calculated Property |
| η | 0.0047927 | Pa×s | 305.81 | Calculated Property |
| η | 0.0022449 | Pa×s | 332.16 | Calculated Property |
| η | 0.0011755 | Pa×s | 358.51 | Calculated Property |
| η | 0.0006726 | Pa×s | 384.85 | Calculated Property |
| η | 0.0004133 | Pa×s | 411.20 | Calculated Property |
| η | 0.0002694 | Pa×s | 437.55 | Calculated Property |
| η | 0.0001843 | Pa×s | 463.89 | Calculated Property |
| η | 0.0001313 | Pa×s | 490.24 | Calculated Property |
Similar Compounds
Find more compounds similar to (E)-4, (Z)-7-decadienol-1.
Sources
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