- InChI
- InChI=1S/C13H22O4/c1-5-6-9-16-12(14)7-8-13(15)17-11(4)10(2)3/h5,10-11H,1,6-9H2,2-4H3
- InChI Key
- QJUBXZHVTFKCOP-UHFFFAOYSA-N
- Formula
- C13H22O4
- SMILES
- C=CCCOC(=O)CCC(=O)OC(C)C(C)C
- Molecular Weight1
- 242.31
- 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° | -326.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -686.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.40 | kJ/mol | Joback Calculated Property |
| log10WS | -2.71 | Crippen Calculated Property | |
| logPoct/wat | 2.474 | Crippen Calculated Property | |
| McVol | 204.610 | ml/mol | McGowan Calculated Property |
| Pc | 1864.33 | kPa | Joback Calculated Property |
| Inp | [1532.00; 1532.00] |
|
|
| Inp | 1532.00 | NIST | |
| Inp | 1532.00 | NIST | |
| Tboil | 645.22 | K | Joback Calculated Property |
| Tc | 829.76 | K | Joback Calculated Property |
| Tfus | 348.83 | K | Joback Calculated Property |
| Vc | 0.780 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [546.73; 626.55] | J/mol×K | [645.22; 829.76] |
|
| Cp,gas | 546.73 | J/mol×K | 645.22 | Joback Calculated Property |
| Cp,gas | 561.85 | J/mol×K | 675.98 | Joback Calculated Property |
| Cp,gas | 576.24 | J/mol×K | 706.73 | Joback Calculated Property |
| Cp,gas | 589.89 | J/mol×K | 737.49 | Joback Calculated Property |
| Cp,gas | 602.83 | J/mol×K | 768.24 | Joback Calculated Property |
| Cp,gas | 615.04 | J/mol×K | 799.00 | Joback Calculated Property |
| Cp,gas | 626.55 | J/mol×K | 829.76 | Joback Calculated Property |
| η | [0.0001225; 0.0024709] | Pa×s | [348.83; 645.22] |
|
| η | 0.0024709 | Pa×s | 348.83 | Joback Calculated Property |
| η | 0.0010978 | Pa×s | 398.23 | Joback Calculated Property |
| η | 0.0005833 | Pa×s | 447.63 | Joback Calculated Property |
| η | 0.0003515 | Pa×s | 497.03 | Joback Calculated Property |
| η | 0.0002321 | Pa×s | 546.42 | Joback Calculated Property |
| η | 0.0001642 | Pa×s | 595.82 | Joback Calculated Property |
| η | 0.0001225 | Pa×s | 645.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 3-methylbut-2-yl but-3-en-1-yl ester.
Sources
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