- InChI
- InChI=1S/C16H30O5/c1-5-6-7-8-9-10-20-14(17)11-19-12-15(18)21-13-16(2,3)4/h5-13H2,1-4H3
- InChI Key
- ULNLYJYVOYAJEU-UHFFFAOYSA-N
- Formula
- C16H30O5
- SMILES
-
CCCCCCCOC(=O)COCC(=O)OCC(C)(C)
C - 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° | -486.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1004.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.64 | kJ/mol | Joback Calculated Property |
| log10WS | -3.09 | Crippen Calculated Property | |
| logPoct/wat | 3.106 | Crippen Calculated Property | |
| McVol | 257.050 | ml/mol | McGowan Calculated Property |
| Pc | 1413.31 | kPa | Joback Calculated Property |
| Inp | [2381.00; 2381.00] |
|
|
| Inp | 2381.00 | NIST | |
| Inp | 2381.00 | NIST | |
| Tboil | 737.25 | K | Joback Calculated Property |
| Tc | 919.61 | K | Joback Calculated Property |
| Tfus | 439.05 | K | Joback Calculated Property |
| Vc | 0.987 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [765.53; 851.66] | J/mol×K | [737.25; 919.61] |
|
| Cp,gas | 765.53 | J/mol×K | 737.25 | Joback Calculated Property |
| Cp,gas | 782.11 | J/mol×K | 767.64 | Joback Calculated Property |
| Cp,gas | 797.78 | J/mol×K | 798.04 | Joback Calculated Property |
| Cp,gas | 812.56 | J/mol×K | 828.43 | Joback Calculated Property |
| Cp,gas | 826.46 | J/mol×K | 858.82 | Joback Calculated Property |
| Cp,gas | 839.49 | J/mol×K | 889.21 | Joback Calculated Property |
| Cp,gas | 851.66 | J/mol×K | 919.61 | Joback Calculated Property |
| η | [0.0000581; 0.0008535] | Pa×s | [439.05; 737.25] |
|
| η | 0.0008535 | Pa×s | 439.05 | Joback Calculated Property |
| η | 0.0004344 | Pa×s | 488.75 | Joback Calculated Property |
| η | 0.0002504 | Pa×s | 538.45 | Joback Calculated Property |
| η | 0.0001585 | Pa×s | 588.15 | Joback Calculated Property |
| η | 0.0001077 | Pa×s | 637.85 | Joback Calculated Property |
| η | 0.0000774 | Pa×s | 687.55 | Joback Calculated Property |
| η | 0.0000581 | Pa×s | 737.25 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, heptyl neopentyl ester.
Sources
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