- InChI
- InChI=1S/C24H30O4/c1-2-3-4-5-6-7-10-17-27-23(25)15-16-24(26)28-19-20-13-14-21-11-8-9-12-22(21)18-20/h6-9,11-14,18H,2-5,10,15-17,19H2,1H3/b7-6+
- InChI Key
- NKJPQJMYBOHKKY-VOTSOKGWSA-N
- Formula
- C24H30O4
- SMILES
-
CCCCCC=CCCOC(=O)CCC(=O)OCc1ccc
2ccccc2c1 - Molecular Weight1
- 382.49
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- 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 | 0.9560 | Relay (1.0) Calculated Property | |
| ΔfusH° | 57.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 122.45 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 5.733 | Crippen Calculated Property | |
| McVol | 316.380 | ml/mol | McGowan Calculated Property |
| Pc | 1189.88 | kPa | Joback Calculated Property |
| Inp | [3127.00; 3127.00] |
|
|
| Inp | 3127.00 | NIST | |
| Inp | 3127.00 | NIST | |
| Tboil | 709.67 | K | Relay (1.0) Calculated Property |
| Tc | 933.45 | K | Relay (1.0) Calculated Property |
| Tfus | 305.84 | K | Relay (1.0) Calculated Property |
| Vc | 1.145 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [437.58; 1030.80] | 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 | -3.33410e+01 | |||
| Coefficient B | 2.05212e+00 | |||
| Coefficient C | -1.27728e-03 | |||
| Coefficient D | 2.89300e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 437.58 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 545.60 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 640.96 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 724.57 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 797.35 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 860.22 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 914.08 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 959.85 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 998.45 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1030.80 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0005682; 0.0000700] | Pa×s | [511.46; 794.02] |
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 | -1.33593e+01 | |||
| Coefficient B | 3.01056e+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. | 511.46 | |||
| Temperature range, max. | 794.02 | |||
| η | 0.0005682 | Pa×s | 511.46 | Calculated Property |
| η | 0.0004042 | Pa×s | 542.86 | Calculated Property |
| η | 0.0002985 | Pa×s | 574.25 | Calculated Property |
| η | 0.0002275 | Pa×s | 605.65 | Calculated Property |
| η | 0.0001781 | Pa×s | 637.04 | Calculated Property |
| η | 0.0001426 | Pa×s | 668.44 | Calculated Property |
| η | 0.0001165 | Pa×s | 699.83 | Calculated Property |
| η | 0.0000969 | Pa×s | 731.23 | Calculated Property |
| η | 0.0000818 | Pa×s | 762.62 | Calculated Property |
| η | 0.0000700 | Pa×s | 794.02 | Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, naphth-2-ylmethyl non-3-en-1-yl ester.
Sources
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