- InChI
- InChI=1S/C16H20Cl2O5/c1-11(2)5-4-8-22-14(19)9-21-10-15(20)23-13-7-3-6-12(17)16(13)18/h3,6-7,11H,4-5,8-10H2,1-2H3
- InChI Key
- BSJSIFBVBFFULB-UHFFFAOYSA-N
- Formula
- C16H20Cl2O5
- SMILES
-
CC(C)CCCOC(=O)COCC(=O)Oc1cccc(
Cl)c1Cl - Molecular Weight1
- 363.23
- 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° | -422.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -818.56 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.91 | kJ/mol | Joback Calculated Property |
| log10WS | -4.21 | Crippen Calculated Property | |
| logPoct/wat | 3.895 | Crippen Calculated Property | |
| McVol | 257.770 | ml/mol | McGowan Calculated Property |
| Pc | 1674.16 | kPa | Joback Calculated Property |
| Inp | [3018.00; 3018.00] |
|
|
| Inp | 3018.00 | NIST | |
| Inp | 3018.00 | NIST | |
| Tboil | 851.54 | K | Joback Calculated Property |
| Tc | 1064.03 | K | Joback Calculated Property |
| Tfus | 532.93 | K | Joback Calculated Property |
| Vc | 0.982 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [726.08; 784.00] | J/mol×K | [851.54; 1064.03] |
|
| Cp,gas | 726.08 | J/mol×K | 851.54 | Joback Calculated Property |
| Cp,gas | 738.53 | J/mol×K | 886.96 | Joback Calculated Property |
| Cp,gas | 749.86 | J/mol×K | 922.37 | Joback Calculated Property |
| Cp,gas | 760.08 | J/mol×K | 957.79 | Joback Calculated Property |
| Cp,gas | 769.18 | J/mol×K | 993.20 | Joback Calculated Property |
| Cp,gas | 777.15 | J/mol×K | 1028.62 | Joback Calculated Property |
| Cp,gas | 784.00 | J/mol×K | 1064.03 | Joback Calculated Property |
| η | [0.0000501; 0.0004081] | Pa×s | [532.93; 851.54] |
|
| η | 0.0004081 | Pa×s | 532.93 | Joback Calculated Property |
| η | 0.0002456 | Pa×s | 586.03 | Joback Calculated Property |
| η | 0.0001608 | Pa×s | 639.13 | Joback Calculated Property |
| η | 0.0001123 | Pa×s | 692.24 | Joback Calculated Property |
| η | 0.0000826 | Pa×s | 745.34 | Joback Calculated Property |
| η | 0.0000633 | Pa×s | 798.44 | Joback Calculated Property |
| η | 0.0000501 | Pa×s | 851.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, 2,3-dichlorophenyl isohexyl ester.
Sources
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