- InChI
- InChI=1S/C11H22O3/c1-2-3-4-5-6-7-8-11(13)14-10-9-12/h12H,2-10H2,1H3
- InChI Key
- FYEXIVKYDZIYEG-UHFFFAOYSA-N
- Formula
- C11H22O3
- SMILES
- CCCCCCCCC(=O)OCCO
- Molecular Weight1
- 202.29
- 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 | 0.8802 | Relay (1.0) Calculated Property | |
| ΔfG° | -405.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -753.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 32.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.36 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.92 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.70 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.273 | Crippen Calculated Property | |
| McVol | 179.160 | ml/mol | McGowan Calculated Property |
| Pc | 2110.00 | kPa | Joback Calculated Property |
| Inp | 1498.00 | NIST | |
| Tboil | 551.21 | K | Relay (1.0) Calculated Property |
| Tc | 733.73 | K | Relay (1.0) Calculated Property |
| Tfus | 275.80 | K | Relay (1.0) Calculated Property |
| Vc | 0.684 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [267.67; 613.61] | 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 | 2.35890e+01 | |||
| Coefficient B | 1.02802e+00 | |||
| Coefficient C | -5.10400e-04 | |||
| Coefficient D | 7.24000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 267.67 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 326.60 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 379.88 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 427.72 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 470.37 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 508.04 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 540.98 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 569.39 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 593.53 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 613.61 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0108837; 0.0001261] | Pa×s | [316.88; 535.99] |
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 | -1.54253e+01 | |||
| Coefficient B | 3.45551e+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. | 316.88 | |||
| Temperature range, max. | 535.99 | |||
| η | 0.0108837 | Pa×s | 316.88 | Calculated Property |
| η | 0.0049991 | Pa×s | 341.23 | Calculated Property |
| η | 0.0025468 | Pa×s | 365.57 | Calculated Property |
| η | 0.0014115 | Pa×s | 389.92 | Calculated Property |
| η | 0.0008385 | Pa×s | 414.26 | Calculated Property |
| η | 0.0005277 | Pa×s | 438.61 | Calculated Property |
| η | 0.0003487 | Pa×s | 462.95 | Calculated Property |
| η | 0.0002402 | Pa×s | 487.30 | Calculated Property |
| η | 0.0001714 | Pa×s | 511.64 | Calculated Property |
| η | 0.0001261 | Pa×s | 535.99 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Hydroxyethyl nonanoate.
Sources
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