- InChI
- InChI=1S/C20H38O5/c1-5-6-7-8-9-10-11-12-13-14-24-18(21)15-23-16-19(22)25-17-20(2,3)4/h5-17H2,1-4H3
- InChI Key
- BQZVRQWNMHGHKA-UHFFFAOYSA-N
- Formula
- C20H38O5
- SMILES
-
CCCCCCCCCCCOC(=O)COCC(=O)OCC(C
)(C)C - Molecular Weight1
- 358.51
- 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° | -452.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1086.70 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.54 | kJ/mol | Joback Calculated Property |
| log10WS | -4.77 | Crippen Calculated Property | |
| logPoct/wat | 4.666 | Crippen Calculated Property | |
| McVol | 313.410 | ml/mol | McGowan Calculated Property |
| Pc | 1079.22 | kPa | Joback Calculated Property |
| Inp | [2876.00; 2876.00] |
|
|
| Inp | 2876.00 | NIST | |
| Inp | 2876.00 | NIST | |
| Tboil | 828.77 | K | Joback Calculated Property |
| Tc | 1017.43 | K | Joback Calculated Property |
| Tfus | 484.13 | K | Joback Calculated Property |
| Vc | 1.210 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1001.66; 1093.00] | J/mol×K | [828.77; 1017.43] |
|
| Cp,gas | 1001.66 | J/mol×K | 828.77 | Joback Calculated Property |
| Cp,gas | 1019.60 | J/mol×K | 860.21 | Joback Calculated Property |
| Cp,gas | 1036.43 | J/mol×K | 891.66 | Joback Calculated Property |
| Cp,gas | 1052.17 | J/mol×K | 923.10 | Joback Calculated Property |
| Cp,gas | 1066.82 | J/mol×K | 954.55 | Joback Calculated Property |
| Cp,gas | 1080.43 | J/mol×K | 985.99 | Joback Calculated Property |
| Cp,gas | 1093.00 | J/mol×K | 1017.43 | Joback Calculated Property |
| η | [0.0000316; 0.0005354] | Pa×s | [484.13; 828.77] |
|
| η | 0.0005354 | Pa×s | 484.13 | Joback Calculated Property |
| η | 0.0002603 | Pa×s | 541.57 | Joback Calculated Property |
| η | 0.0001453 | Pa×s | 599.01 | Joback Calculated Property |
| η | 0.0000898 | Pa×s | 656.45 | Joback Calculated Property |
| η | 0.0000600 | Pa×s | 713.89 | Joback Calculated Property |
| η | 0.0000425 | Pa×s | 771.33 | Joback Calculated Property |
| η | 0.0000316 | Pa×s | 828.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, neopentyl undecyl ester.
Sources
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