- InChI
- InChI=1S/C11H18O4/c1-14-10(12)8-6-4-3-5-7-9-11(13)15-2/h6,8H,3-5,7,9H2,1-2H3/b8-6-
- InChI Key
- AYRXFAMQOIQKRZ-VURMDHGXSA-N
- Formula
- C11H18O4
- SMILES
- COC(=O)C=CCCCCCC(=O)OC
- Molecular Weight1
- 214.26
- 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° | -345.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -642.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.35 | kJ/mol | Joback Calculated Property |
| log10WS | -2.01 | Crippen Calculated Property | |
| logPoct/wat | 1.839 | Crippen Calculated Property | |
| McVol | 176.430 | ml/mol | McGowan Calculated Property |
| Pc | 2204.15 | kPa | Joback Calculated Property |
| Inp | [1571.00; 1571.00] |
|
|
| Inp | 1571.00 | NIST | |
| Inp | 1571.00 | NIST | |
| Tboil | 607.82 | K | Joback Calculated Property |
| Tc | 793.03 | K | Joback Calculated Property |
| Tfus | 352.97 | K | Joback Calculated Property |
| Vc | 0.679 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [444.66; 516.13] | J/mol×K | [607.82; 793.03] |
|
| Cp,gas | 444.66 | J/mol×K | 607.82 | Joback Calculated Property |
| Cp,gas | 458.09 | J/mol×K | 638.69 | Joback Calculated Property |
| Cp,gas | 470.91 | J/mol×K | 669.56 | Joback Calculated Property |
| Cp,gas | 483.11 | J/mol×K | 700.43 | Joback Calculated Property |
| Cp,gas | 494.71 | J/mol×K | 731.29 | Joback Calculated Property |
| Cp,gas | 505.71 | J/mol×K | 762.16 | Joback Calculated Property |
| Cp,gas | 516.13 | J/mol×K | 793.03 | Joback Calculated Property |
| η | [0.0001454; 0.0016775] | Pa×s | [352.97; 607.82] |
|
| η | 0.0016775 | Pa×s | 352.97 | Joback Calculated Property |
| η | 0.0008965 | Pa×s | 395.44 | Joback Calculated Property |
| η | 0.0005410 | Pa×s | 437.92 | Joback Calculated Property |
| η | 0.0003570 | Pa×s | 480.39 | Joback Calculated Property |
| η | 0.0002520 | Pa×s | 522.87 | Joback Calculated Property |
| η | 0.0001875 | Pa×s | 565.35 | Joback Calculated Property |
| η | 0.0001454 | Pa×s | 607.82 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Methyl-non-2-enedioic acid dimethyl ester, Z.
Sources
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