- InChI
- InChI=1S/C16H30O5/c1-3-5-7-8-10-12-21-16(18)14-19-13-15(17)20-11-9-6-4-2/h3-14H2,1-2H3
- InChI Key
- VWERRMLHCPBCQG-UHFFFAOYSA-N
- Formula
- C16H30O5
- SMILES
- CCCCCCCOC(=O)COCC(=O)OCCCCC
- 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° | -489.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -995.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.93 | kJ/mol | Joback Calculated Property |
| log10WS | -3.33 | Crippen Calculated Property | |
| logPoct/wat | 3.250 | Crippen Calculated Property | |
| McVol | 257.050 | ml/mol | McGowan Calculated Property |
| Pc | 1393.33 | kPa | Joback Calculated Property |
| Inp | [2513.00; 2513.00] |
|
|
| Inp | 2513.00 | NIST | |
| Inp | 2513.00 | NIST | |
| Tboil | 740.48 | K | Joback Calculated Property |
| Tc | 918.04 | K | Joback Calculated Property |
| Tfus | 436.63 | K | Joback Calculated Property |
| Vc | 0.998 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [763.64; 849.16] | J/mol×K | [740.48; 918.04] |
|
| Cp,gas | 763.64 | J/mol×K | 740.48 | Joback Calculated Property |
| Cp,gas | 780.01 | J/mol×K | 770.07 | Joback Calculated Property |
| Cp,gas | 795.54 | J/mol×K | 799.67 | Joback Calculated Property |
| Cp,gas | 810.22 | J/mol×K | 829.26 | Joback Calculated Property |
| Cp,gas | 824.05 | J/mol×K | 858.86 | Joback Calculated Property |
| Cp,gas | 837.03 | J/mol×K | 888.45 | Joback Calculated Property |
| Cp,gas | 849.16 | J/mol×K | 918.04 | Joback Calculated Property |
| η | [0.0000704; 0.0008707] | Pa×s | [436.63; 740.48] |
|
| η | 0.0008707 | Pa×s | 436.63 | Joback Calculated Property |
| η | 0.0004605 | Pa×s | 487.27 | Joback Calculated Property |
| η | 0.0002746 | Pa×s | 537.91 | Joback Calculated Property |
| η | 0.0001790 | Pa×s | 588.56 | Joback Calculated Property |
| η | 0.0001249 | Pa×s | 639.20 | Joback Calculated Property |
| η | 0.0000918 | Pa×s | 689.84 | Joback Calculated Property |
| η | 0.0000704 | Pa×s | 740.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, heptyl pentyl ester.
Sources
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