- InChI
- InChI=1S/C19H36O5/c1-5-6-7-12-23-18(20)14-22-15-19(21)24-13-11-17(4)10-8-9-16(2)3/h16-17H,5-15H2,1-4H3
- InChI Key
- QXKNQOFGTMQMMN-UHFFFAOYSA-N
- Formula
- C19H36O5
- SMILES
-
CCCCCOC(=O)COCC(=O)OCCC(C)CCCC
(C)C - Molecular Weight1
- 344.49
- 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° | -468.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1067.87 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.83 | kJ/mol | Joback Calculated Property |
| log10WS | -4.10 | Crippen Calculated Property | |
| logPoct/wat | 4.132 | Crippen Calculated Property | |
| McVol | 299.320 | ml/mol | McGowan Calculated Property |
| Pc | 1148.32 | kPa | Joback Calculated Property |
| Inp | [2755.00; 2755.00] |
|
|
| Inp | 2755.00 | NIST | |
| Inp | 2755.00 | NIST | |
| Tboil | 808.24 | K | Joback Calculated Property |
| Tc | 993.75 | K | Joback Calculated Property |
| Tfus | 440.44 | K | Joback Calculated Property |
| Vc | 1.153 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [941.23; 1031.79] | J/mol×K | [808.24; 993.75] |
|
| Cp,gas | 941.23 | J/mol×K | 808.24 | Joback Calculated Property |
| Cp,gas | 959.02 | J/mol×K | 839.16 | Joback Calculated Property |
| Cp,gas | 975.71 | J/mol×K | 870.08 | Joback Calculated Property |
| Cp,gas | 991.34 | J/mol×K | 900.99 | Joback Calculated Property |
| Cp,gas | 1005.88 | J/mol×K | 931.91 | Joback Calculated Property |
| Cp,gas | 1019.37 | J/mol×K | 962.83 | Joback Calculated Property |
| Cp,gas | 1031.79 | J/mol×K | 993.75 | Joback Calculated Property |
| η | [0.0000389; 0.0008930] | Pa×s | [440.44; 808.24] |
|
| η | 0.0008930 | Pa×s | 440.44 | Joback Calculated Property |
| η | 0.0003849 | Pa×s | 501.74 | Joback Calculated Property |
| η | 0.0001993 | Pa×s | 563.04 | Joback Calculated Property |
| η | 0.0001174 | Pa×s | 624.34 | Joback Calculated Property |
| η | 0.0000760 | Pa×s | 685.64 | Joback Calculated Property |
| η | 0.0000529 | Pa×s | 746.94 | Joback Calculated Property |
| η | 0.0000389 | Pa×s | 808.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, 3,7-dimethyloctyl pentyl ester.
Sources
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