- InChI
- InChI=1S/C13H24O2/c1-3-5-6-7-8-9-10-11-12-13(14)15-4-2/h3H,1,4-12H2,2H3
- InChI Key
- FXNFFCMITPHEIT-UHFFFAOYSA-N
- Formula
- C13H24O2
- SMILES
- C=CCCCCCCCCC(=O)OCC
- Molecular Weight1
- 212.33
- CAS
- 692-86-4
- Other Names
-
- Ethyl 10-hendecenoate
- Ethyl 10-undecenoate
- Ethyl undecenoate
- Ethyl undecylenate
- Undecenoic acid, ethyl ester
- ethyl undec-10-enoate
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 | 0.6691 | Relay (1.0) Calculated Property | |
| ΔfG° | -87.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -527.93 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 30.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.16 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.32 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.17 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.856 | Crippen Calculated Property | |
| McVol | 197.170 | ml/mol | McGowan Calculated Property |
| Pc | 1768.38 | kPa | Joback Calculated Property |
| Inp | 1469.00 | NIST | |
| Tboil | 537.70 | K | NIST |
| Tc | 704.55 | K | Relay (1.0) Calculated Property |
| Tfus | 256.87 | K | Relay (1.0) Calculated Property |
| Vc | 0.738 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [494.21; 579.50] | J/mol×K | [569.81; 741.25] | 
|
| Cp,gas | 494.21 | J/mol×K | 569.81 | Joback Calculated Property |
| Cp,gas | 510.03 | J/mol×K | 598.38 | Joback Calculated Property |
| Cp,gas | 525.18 | J/mol×K | 626.96 | Joback Calculated Property |
| Cp,gas | 539.69 | J/mol×K | 655.53 | Joback Calculated Property |
| Cp,gas | 553.58 | J/mol×K | 684.10 | Joback Calculated Property |
| Cp,gas | 566.84 | J/mol×K | 712.68 | Joback Calculated Property |
| Cp,gas | 579.50 | J/mol×K | 741.25 | Joback Calculated Property |
| η | [0.0001759; 0.0027987] | Pa×s | [306.67; 569.81] |
|
| η | 0.0027987 | Pa×s | 306.67 | Joback Calculated Property |
| η | 0.0013224 | Pa×s | 350.53 | Joback Calculated Property |
| η | 0.0007382 | Pa×s | 394.38 | Joback Calculated Property |
| η | 0.0004631 | Pa×s | 438.24 | Joback Calculated Property |
| η | 0.0003162 | Pa×s | 482.10 | Joback Calculated Property |
| η | 0.0002301 | Pa×s | 525.95 | Joback Calculated Property |
| η | 0.0001759 | Pa×s | 569.81 | Joback Calculated Property |
| ΔvapH | 77.40 | kJ/mol | 468.00 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [404.70; 531.70] | K | [2.10; 101.00] |
|
| Tboilr | 404.70 | K | 2.10 | NIST |
| Tboilr | 531.70 | K | 101.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [410.82; 567.97] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.55477e+01 | |||
| Coefficient B | -4.88633e+03 | |||
| Coefficient C | -9.06170e+01 | |||
| Temperature range, min. | 410.82 | |||
| Temperature range, max. | 567.97 | |||
| Pvap | 1.33 | kPa | 410.82 | Calculated Property |
| Pvap | 2.94 | kPa | 428.28 | Calculated Property |
| Pvap | 5.98 | kPa | 445.74 | Calculated Property |
| Pvap | 11.39 | kPa | 463.20 | Calculated Property |
| Pvap | 20.49 | kPa | 480.66 | Calculated Property |
| Pvap | 35.06 | kPa | 498.13 | Calculated Property |
| Pvap | 57.38 | kPa | 515.59 | Calculated Property |
| Pvap | 90.32 | kPa | 533.05 | Calculated Property |
| Pvap | 137.38 | kPa | 550.51 | Calculated Property |
| Pvap | 202.63 | kPa | 567.97 | Calculated Property |
Similar Compounds
Find more compounds similar to 10-Undecenoic acid, ethyl ester.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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