- InChI
- InChI=1S/C20H38O4/c1-5-7-9-11-13-15-17-24-19(22)20(3,4)18(21)23-16-14-12-10-8-6-2/h5-17H2,1-4H3
- InChI Key
- CMTUYYPWBPYIIR-UHFFFAOYSA-N
- Formula
- C20H38O4
- SMILES
-
CCCCCCCCOC(=O)C(C)(C)C(=O)OCCC
CCCC - Molecular Weight1
- 342.51
- 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° | -347.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -954.48 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 45.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.13 | kJ/mol | Joback Calculated Property |
| log10WS | -5.68 | Crippen Calculated Property | |
| logPoct/wat | 5.430 | Crippen Calculated Property | |
| McVol | 307.540 | ml/mol | McGowan Calculated Property |
| Pc | 1091.38 | kPa | Joback Calculated Property |
| Inp | [2116.00; 2116.00] |
|
|
| Inp | 2116.00 | NIST | |
| Inp | 2116.00 | NIST | |
| Tboil | 806.35 | K | Joback Calculated Property |
| Tc | 992.19 | K | Joback Calculated Property |
| Tfus | 461.90 | K | Joback Calculated Property |
| Vc | 1.192 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [970.19; 1064.44] | J/mol×K | [806.35; 992.19] |
|
| Cp,gas | 970.19 | J/mol×K | 806.35 | Joback Calculated Property |
| Cp,gas | 988.42 | J/mol×K | 837.32 | Joback Calculated Property |
| Cp,gas | 1005.60 | J/mol×K | 868.30 | Joback Calculated Property |
| Cp,gas | 1021.76 | J/mol×K | 899.27 | Joback Calculated Property |
| Cp,gas | 1036.94 | J/mol×K | 930.24 | Joback Calculated Property |
| Cp,gas | 1051.16 | J/mol×K | 961.22 | Joback Calculated Property |
| Cp,gas | 1064.44 | J/mol×K | 992.19 | Joback Calculated Property |
| η | [0.0000427; 0.0008014] | Pa×s | [461.90; 806.35] |
|
| η | 0.0008014 | Pa×s | 461.90 | Joback Calculated Property |
| η | 0.0003752 | Pa×s | 519.31 | Joback Calculated Property |
| η | 0.0002043 | Pa×s | 576.72 | Joback Calculated Property |
| η | 0.0001242 | Pa×s | 634.12 | Joback Calculated Property |
| η | 0.0000820 | Pa×s | 691.53 | Joback Calculated Property |
| η | 0.0000577 | Pa×s | 748.94 | Joback Calculated Property |
| η | 0.0000427 | Pa×s | 806.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, heptyl octyl ester.
Sources
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