- InChI
- InChI=1S/C18H34O4/c1-5-7-9-11-13-15-22-17(20)18(3,4)16(19)21-14-12-10-8-6-2/h5-15H2,1-4H3
- InChI Key
- MGQMQOUJLSQJTI-UHFFFAOYSA-N
- Formula
- C18H34O4
- SMILES
-
CCCCCCCOC(=O)C(C)(C)C(=O)OCCCC
CC - Molecular Weight1
- 314.46
- 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° | -364.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -913.20 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.68 | kJ/mol | Joback Calculated Property |
| log10WS | -4.84 | Crippen Calculated Property | |
| logPoct/wat | 4.650 | Crippen Calculated Property | |
| McVol | 279.360 | ml/mol | McGowan Calculated Property |
| Pc | 1244.21 | kPa | Joback Calculated Property |
| Inp | [1925.00; 1925.00] |
|
|
| Inp | 1925.00 | NIST | |
| Inp | 1925.00 | NIST | |
| Tboil | 760.59 | K | Joback Calculated Property |
| Tc | 943.17 | K | Joback Calculated Property |
| Tfus | 439.36 | K | Joback Calculated Property |
| Vc | 1.081 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [851.04; 942.42] | J/mol×K | [760.59; 943.17] |
|
| Cp,gas | 851.04 | J/mol×K | 760.59 | Joback Calculated Property |
| Cp,gas | 868.59 | J/mol×K | 791.02 | Joback Calculated Property |
| Cp,gas | 885.17 | J/mol×K | 821.45 | Joback Calculated Property |
| Cp,gas | 900.82 | J/mol×K | 851.88 | Joback Calculated Property |
| Cp,gas | 915.57 | J/mol×K | 882.31 | Joback Calculated Property |
| Cp,gas | 929.42 | J/mol×K | 912.74 | Joback Calculated Property |
| Cp,gas | 942.42 | J/mol×K | 943.17 | Joback Calculated Property |
| η | [0.0000577; 0.0010148] | Pa×s | [439.36; 760.59] |
|
| η | 0.0010148 | Pa×s | 439.36 | Joback Calculated Property |
| η | 0.0004855 | Pa×s | 492.90 | Joback Calculated Property |
| η | 0.0002684 | Pa×s | 546.44 | Joback Calculated Property |
| η | 0.0001649 | Pa×s | 599.97 | Joback Calculated Property |
| η | 0.0001097 | Pa×s | 653.51 | Joback Calculated Property |
| η | 0.0000777 | Pa×s | 707.05 | Joback Calculated Property |
| η | 0.0000577 | Pa×s | 760.59 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, heptyl hexyl ester.
Sources
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