- InChI
- InChI=1S/C15H28O2/c1-3-5-7-8-9-10-11-12-14-17-15(16)13-6-4-2/h3H,1,4-14H2,2H3
- InChI Key
- CZQAUYHFZOOTSH-UHFFFAOYSA-N
- Formula
- C15H28O2
- SMILES
- C=CCCCCCCCCOC(=O)CCCC
- Molecular Weight1
- 240.38
- Other Names
-
- 9-Decen-1-yl pentanoate
- 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 | 0.7537 | Relay (1.0) Calculated Property | |
| ΔfG° | -147.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -567.66 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 37.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.26 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.32 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.69 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.636 | Crippen Calculated Property | |
| McVol | 225.350 | ml/mol | McGowan Calculated Property |
| Pc | 1466.85 | kPa | Joback Calculated Property |
| Inp | [1629.00; 1629.00] |
|
|
| Inp | 1629.00 | NIST | |
| Inp | 1629.00 | NIST | |
| Tboil | 559.64 | K | Relay (1.0) Calculated Property |
| Tc | 731.05 | K | Relay (1.0) Calculated Property |
| Tfus | 242.27 | K | Relay (1.0) Calculated Property |
| Vc | 0.850 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [330.22; 772.79] | 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 | 1.16710e+01 | |||
| Coefficient B | 1.35402e+00 | |||
| Coefficient C | -7.20500e-04 | |||
| Coefficient D | 1.27600e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 330.22 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 406.17 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 474.48 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 535.56 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 589.82 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 637.65 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 679.46 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 715.65 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 746.62 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 772.79 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0039425; 0.0001933] | Pa×s | [299.38; 535.45] |
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 | -1.23747e+01 | |||
| Coefficient B | 2.04740e+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. | 299.38 | |||
| Temperature range, max. | 535.45 | |||
| η | 0.0039425 | Pa×s | 299.38 | Calculated Property |
| η | 0.0022726 | Pa×s | 325.61 | Calculated Property |
| η | 0.0014221 | Pa×s | 351.84 | Calculated Property |
| η | 0.0009497 | Pa×s | 378.07 | Calculated Property |
| η | 0.0006684 | Pa×s | 404.30 | Calculated Property |
| η | 0.0004909 | Pa×s | 430.53 | Calculated Property |
| η | 0.0003736 | Pa×s | 456.76 | Calculated Property |
| η | 0.0002929 | Pa×s | 482.99 | Calculated Property |
| η | 0.0002354 | Pa×s | 509.22 | Calculated Property |
| η | 0.0001933 | Pa×s | 535.45 | Calculated Property |
Similar Compounds
Find more compounds similar to Pentanoic acid, 9-decenyl ester.
Sources
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