- InChI
- InChI=1S/C19H24O5/c1-5-9-15(6-2)23-18(20)12-13-19(21)24-17-11-8-7-10-16(17)22-14(3)4/h7-8,10-11,14-15H,6,12-13H2,1-4H3
- InChI Key
- MPKMSXPTBGPUBR-UHFFFAOYSA-N
- Formula
- C19H24O5
- SMILES
-
CC#CC(CC)OC(=O)CCC(=O)Oc1ccccc
1OC(C)C - Molecular Weight1
- 332.39
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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° | -163.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -570.51 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.92 | kJ/mol | Joback Calculated Property |
| log10WS | -4.97 | Crippen Calculated Property | |
| logPoct/wat | 3.505 | Crippen Calculated Property | |
| McVol | 266.960 | ml/mol | McGowan Calculated Property |
| Pc | 1632.49 | kPa | Joback Calculated Property |
| Inp | 2285.00 | NIST | |
| Tboil | 848.90 | K | Joback Calculated Property |
| Tc | 1066.67 | K | Joback Calculated Property |
| Tfus | 585.48 | K | Joback Calculated Property |
| Vc | 1.008 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [797.43; 868.28] | J/mol×K | [848.90; 1066.67] | 
|
| Cp,gas | 797.43 | J/mol×K | 848.90 | Joback Calculated Property |
| Cp,gas | 812.44 | J/mol×K | 885.20 | Joback Calculated Property |
| Cp,gas | 826.17 | J/mol×K | 921.49 | Joback Calculated Property |
| Cp,gas | 838.62 | J/mol×K | 957.79 | Joback Calculated Property |
| Cp,gas | 849.78 | J/mol×K | 994.08 | Joback Calculated Property |
| Cp,gas | 859.67 | J/mol×K | 1030.38 | Joback Calculated Property |
| Cp,gas | 868.28 | J/mol×K | 1066.67 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, hex-4-yn-3-yl 2-isopropoxyphenyl ester.
Sources
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