- InChI
- InChI=1S/C24H44O5/c1-4-5-6-7-8-9-10-11-12-13-14-17-20-28-23(26)18-15-16-19-24(27)29-22(3)21(2)25/h22H,4-20H2,1-3H3
- InChI Key
- SQIDMGKABCMSCM-UHFFFAOYSA-N
- Formula
- C24H44O5
- SMILES
-
CCCCCCCCCCCCCCOC(=O)CCCCC(=O)O
C(C)C(C)=O - Molecular Weight1
- 412.60
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -448.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1146.15 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.69 | kJ/mol | Joback Calculated Property |
| log10WS | -6.99 | Crippen Calculated Property | |
| logPoct/wat | 6.312 | Crippen Calculated Property | |
| McVol | 365.470 | ml/mol | McGowan Calculated Property |
| Pc | 886.30 | kPa | Joback Calculated Property |
| Inp | 2824.00 | NIST | |
| Tboil | 954.53 | K | Joback Calculated Property |
| Tc | 1171.53 | K | Joback Calculated Property |
| Tfus | 539.49 | K | Joback Calculated Property |
| Vc | 1.427 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1239.17; 1327.12] | J/mol×K | [954.53; 1171.53] | 
|
| Cp,gas | 1239.17 | J/mol×K | 954.53 | Joback Calculated Property |
| Cp,gas | 1257.62 | J/mol×K | 990.70 | Joback Calculated Property |
| Cp,gas | 1274.50 | J/mol×K | 1026.86 | Joback Calculated Property |
| Cp,gas | 1289.85 | J/mol×K | 1063.03 | Joback Calculated Property |
| Cp,gas | 1303.71 | J/mol×K | 1099.20 | Joback Calculated Property |
| Cp,gas | 1316.12 | J/mol×K | 1135.36 | Joback Calculated Property |
| Cp,gas | 1327.12 | J/mol×K | 1171.53 | Joback Calculated Property |
| η | [0.0000251; 0.0004535] | Pa×s | [539.49; 954.53] |
|
| η | 0.0004535 | Pa×s | 539.49 | Joback Calculated Property |
| η | 0.0002128 | Pa×s | 608.66 | Joback Calculated Property |
| η | 0.0001166 | Pa×s | 677.84 | Joback Calculated Property |
| η | 0.0000714 | Pa×s | 747.01 | Joback Calculated Property |
| η | 0.0000475 | Pa×s | 816.18 | Joback Calculated Property |
| η | 0.0000337 | Pa×s | 885.36 | Joback Calculated Property |
| η | 0.0000251 | Pa×s | 954.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, 3-oxobut-2-yl tetradecyl ester.
Sources
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