- InChI
- InChI=1S/C20H30O6/c1-3-4-5-6-7-8-13-25-19(21)15-24-16-20(22)26-14-17-9-11-18(23-2)12-10-17/h9-12H,3-8,13-16H2,1-2H3
- InChI Key
- HANKYJXHIVGYMA-UHFFFAOYSA-N
- Formula
- C20H30O6
- SMILES
-
CCCCCCCCOC(=O)COCC(=O)OCc1ccc(
OC)cc1 - Molecular Weight1
- 366.45
- 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° | -457.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -985.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.16 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.18 | kJ/mol | Joback Calculated Property |
| log10WS | -4.31 | Crippen Calculated Property | |
| logPoct/wat | 3.659 | Crippen Calculated Property | |
| McVol | 295.520 | ml/mol | McGowan Calculated Property |
| Pc | 1308.95 | kPa | Joback Calculated Property |
| Inp | [3421.00; 3421.00] |
|
|
| Inp | 3421.00 | NIST | |
| Inp | 3421.00 | NIST | |
| Tboil | 886.08 | K | Joback Calculated Property |
| Tc | 1089.73 | K | Joback Calculated Property |
| Tfus | 542.88 | K | Joback Calculated Property |
| Vc | 1.131 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [936.21; 1006.86] | J/mol×K | [886.08; 1089.73] |
|
| Cp,gas | 936.21 | J/mol×K | 886.08 | Joback Calculated Property |
| Cp,gas | 951.30 | J/mol×K | 920.02 | Joback Calculated Property |
| Cp,gas | 965.06 | J/mol×K | 953.96 | Joback Calculated Property |
| Cp,gas | 977.51 | J/mol×K | 987.90 | Joback Calculated Property |
| Cp,gas | 988.62 | J/mol×K | 1021.84 | Joback Calculated Property |
| Cp,gas | 998.40 | J/mol×K | 1055.79 | Joback Calculated Property |
| Cp,gas | 1006.86 | J/mol×K | 1089.73 | Joback Calculated Property |
| η | [0.0000307; 0.0002917] | Pa×s | [542.88; 886.08] |
|
| η | 0.0002917 | Pa×s | 542.88 | Joback Calculated Property |
| η | 0.0001676 | Pa×s | 600.08 | Joback Calculated Property |
| η | 0.0001060 | Pa×s | 657.28 | Joback Calculated Property |
| η | 0.0000722 | Pa×s | 714.48 | Joback Calculated Property |
| η | 0.0000520 | Pa×s | 771.68 | Joback Calculated Property |
| η | 0.0000392 | Pa×s | 828.88 | Joback Calculated Property |
| η | 0.0000307 | Pa×s | 886.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, 4-methoxybenzyl octyl ester.
Sources
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