- InChI
- InChI=1S/C16H22O7/c1-4-5-9-22-14(17)10-21-11-15(18)23-16-12(19-2)7-6-8-13(16)20-3/h6-8H,4-5,9-11H2,1-3H3
- InChI Key
- DLUQDQUHLWYTPN-UHFFFAOYSA-N
- Formula
- C16H22O7
- SMILES
-
CCCCOC(=O)COCC(=O)Oc1c(OC)cccc
1OC - Molecular Weight1
- 326.34
- 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° | -605.85 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1046.24 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.35 | kJ/mol | Joback Calculated Property |
| log10WS | -2.49 | Crippen Calculated Property | |
| logPoct/wat | 1.969 | Crippen Calculated Property | |
| McVol | 245.030 | ml/mol | McGowan Calculated Property |
| Pc | 1718.88 | kPa | Joback Calculated Property |
| Inp | [2861.00; 2861.00] |
|
|
| Inp | 2861.00 | NIST | |
| Inp | 2861.00 | NIST | |
| Tboil | 821.96 | K | Joback Calculated Property |
| Tc | 1023.82 | K | Joback Calculated Property |
| Tfus | 532.55 | K | Joback Calculated Property |
| Vc | 0.925 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [730.96; 796.11] | J/mol×K | [821.96; 1023.82] |
|
| Cp,gas | 730.96 | J/mol×K | 821.96 | Joback Calculated Property |
| Cp,gas | 744.77 | J/mol×K | 855.60 | Joback Calculated Property |
| Cp,gas | 757.44 | J/mol×K | 889.25 | Joback Calculated Property |
| Cp,gas | 768.94 | J/mol×K | 922.89 | Joback Calculated Property |
| Cp,gas | 779.24 | J/mol×K | 956.53 | Joback Calculated Property |
| Cp,gas | 788.31 | J/mol×K | 990.18 | Joback Calculated Property |
| Cp,gas | 796.11 | J/mol×K | 1023.82 | Joback Calculated Property |
| η | [0.0000412; 0.0002711] | Pa×s | [532.55; 821.96] |
|
| η | 0.0002711 | Pa×s | 532.55 | Joback Calculated Property |
| η | 0.0001738 | Pa×s | 580.78 | Joback Calculated Property |
| η | 0.0001193 | Pa×s | 629.02 | Joback Calculated Property |
| η | 0.0000864 | Pa×s | 677.25 | Joback Calculated Property |
| η | 0.0000653 | Pa×s | 725.49 | Joback Calculated Property |
| η | 0.0000511 | Pa×s | 773.73 | Joback Calculated Property |
| η | 0.0000412 | Pa×s | 821.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, butyl 2,6-dimethoxyphenyl ester.
Sources
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