- InChI
- InChI=1S/C16H30O5/c1-7-11(3)13(5)20-15(17)9-19-10-16(18)21-14(6)12(4)8-2/h11-14H,7-10H2,1-6H3
- InChI Key
- IASDDMMXUYNFNO-UHFFFAOYSA-N
- Formula
- C16H30O5
- SMILES
-
CCC(C)C(C)OC(=O)COCC(=O)OC(C)C
(C)CC - Molecular Weight1
- 302.41
- 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° | -498.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1016.51 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.38 | kJ/mol | Joback Calculated Property |
| log10WS | -3.07 | Crippen Calculated Property | |
| logPoct/wat | 2.959 | Crippen Calculated Property | |
| McVol | 257.050 | ml/mol | McGowan Calculated Property |
| Pc | 1427.22 | kPa | Joback Calculated Property |
| Inp | [2282.00; 2282.00] |
|
|
| Inp | 2282.00 | NIST | |
| Inp | 2282.00 | NIST | |
| Tboil | 738.72 | K | Joback Calculated Property |
| Tc | 923.60 | K | Joback Calculated Property |
| Tfus | 376.63 | K | Joback Calculated Property |
| Vc | 0.974 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [765.61; 853.99] | J/mol×K | [738.72; 923.60] |
|
| Cp,gas | 765.61 | J/mol×K | 738.72 | Joback Calculated Property |
| Cp,gas | 782.72 | J/mol×K | 769.53 | Joback Calculated Property |
| Cp,gas | 798.88 | J/mol×K | 800.35 | Joback Calculated Property |
| Cp,gas | 814.09 | J/mol×K | 831.16 | Joback Calculated Property |
| Cp,gas | 828.35 | J/mol×K | 861.97 | Joback Calculated Property |
| Cp,gas | 841.65 | J/mol×K | 892.79 | Joback Calculated Property |
| Cp,gas | 853.99 | J/mol×K | 923.60 | Joback Calculated Property |
| η | [0.0000510; 0.0020206] | Pa×s | [376.63; 738.72] |
|
| η | 0.0020206 | Pa×s | 376.63 | Joback Calculated Property |
| η | 0.0007166 | Pa×s | 436.98 | Joback Calculated Property |
| η | 0.0003269 | Pa×s | 497.33 | Joback Calculated Property |
| η | 0.0001767 | Pa×s | 557.67 | Joback Calculated Property |
| η | 0.0001077 | Pa×s | 618.02 | Joback Calculated Property |
| η | 0.0000717 | Pa×s | 678.37 | Joback Calculated Property |
| η | 0.0000510 | Pa×s | 738.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, di(3-methylpent-2-yl) ester.
Sources
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