- InChI
- InChI=1S/C16H22O4/c1-11(2)10-19-15(17)8-9-16(18)20-14-7-5-6-12(3)13(14)4/h5-7,11H,8-10H2,1-4H3
- InChI Key
- LRNXBYPGZPCXKY-UHFFFAOYSA-N
- Formula
- C16H22O4
- SMILES
-
Cc1cccc(OC(=O)CCC(=O)OCC(C)C)c
1C - Molecular Weight1
- 278.34
- 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° | -293.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -654.86 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.73 | kJ/mol | Joback Calculated Property |
| log10WS | -3.87 | Crippen Calculated Property | |
| logPoct/wat | 3.188 | Crippen Calculated Property | |
| McVol | 227.420 | ml/mol | McGowan Calculated Property |
| Pc | 1806.16 | kPa | Joback Calculated Property |
| Inp | 2022.00 | NIST | |
| Tboil | 754.26 | K | Joback Calculated Property |
| Tc | 959.78 | K | Joback Calculated Property |
| Tfus | 450.86 | K | Joback Calculated Property |
| Vc | 0.866 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [648.19; 724.85] | J/mol×K | [754.26; 959.78] | 
|
| Cp,gas | 648.19 | J/mol×K | 754.26 | Joback Calculated Property |
| Cp,gas | 663.44 | J/mol×K | 788.51 | Joback Calculated Property |
| Cp,gas | 677.69 | J/mol×K | 822.77 | Joback Calculated Property |
| Cp,gas | 690.94 | J/mol×K | 857.02 | Joback Calculated Property |
| Cp,gas | 703.22 | J/mol×K | 891.28 | Joback Calculated Property |
| Cp,gas | 714.52 | J/mol×K | 925.53 | Joback Calculated Property |
| Cp,gas | 724.85 | J/mol×K | 959.78 | Joback Calculated Property |
| η | [0.0000864; 0.0008196] | Pa×s | [450.86; 754.26] |
|
| η | 0.0008196 | Pa×s | 450.86 | Joback Calculated Property |
| η | 0.0004662 | Pa×s | 501.43 | Joback Calculated Property |
| η | 0.0002941 | Pa×s | 551.99 | Joback Calculated Property |
| η | 0.0002004 | Pa×s | 602.56 | Joback Calculated Property |
| η | 0.0001449 | Pa×s | 653.13 | Joback Calculated Property |
| η | 0.0001098 | Pa×s | 703.69 | Joback Calculated Property |
| η | 0.0000864 | Pa×s | 754.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2,3-dimethylphenyl isobutyl ester.
Sources
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