- InChI
- InChI=1S/C13H24O3/c1-3-5-6-7-8-9-10-11-12-16-13(14)15-4-2/h8-9H,3-7,10-12H2,1-2H3/b9-8-
- InChI Key
- GKCPRHJKDWFHID-HJWRWDBZSA-N
- Formula
- C13H24O3
- SMILES
- CCCCCC=CCCCOC(=O)OCC
- Molecular Weight1
- 228.33
- 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 | 0.6833 | Relay (1.0) Calculated Property | |
| ΔfG° | -276.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -726.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 35.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.43 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.02 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.05 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.076 | Crippen Calculated Property | |
| McVol | 203.040 | ml/mol | McGowan Calculated Property |
| Pc | 1699.10 | kPa | Joback Calculated Property |
| Inp | 1548.00 | NIST | |
| Tboil | 534.86 | K | Relay (1.0) Calculated Property |
| Tc | 685.68 | K | Relay (1.0) Calculated Property |
| Tfus | 210.75 | K | Relay (1.0) Calculated Property |
| Vc | 0.768 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [299.00; 686.04] | 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 | 2.77980e+01 | |||
| Coefficient B | 1.14084e+00 | |||
| Coefficient C | -5.61600e-04 | |||
| Coefficient D | 7.90000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 299.00 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 364.61 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 423.99 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 477.38 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 525.04 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 567.21 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 604.14 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 636.09 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 663.31 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 686.04 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0030324; 0.0001500] | Pa×s | [295.75; 527.79] |
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 | -1.26372e+01 | |||
| Coefficient B | 2.02257e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 295.75 | |||
| Temperature range, max. | 527.79 | |||
| η | 0.0030324 | Pa×s | 295.75 | Calculated Property |
| η | 0.0017524 | Pa×s | 321.53 | Calculated Property |
| η | 0.0010986 | Pa×s | 347.31 | Calculated Property |
| η | 0.0007346 | Pa×s | 373.10 | Calculated Property |
| η | 0.0005175 | Pa×s | 398.88 | Calculated Property |
| η | 0.0003804 | Pa×s | 424.66 | Calculated Property |
| η | 0.0002896 | Pa×s | 450.44 | Calculated Property |
| η | 0.0002271 | Pa×s | 476.22 | Calculated Property |
| η | 0.0001826 | Pa×s | 502.00 | Calculated Property |
| η | 0.0001500 | Pa×s | 527.79 | Calculated Property |
Similar Compounds
Find more compounds similar to (Z)-Dec-4-enyl ethyl carbonate.
Sources
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