- InChI
- InChI=1S/C15H18Cl2O5/c1-2-3-4-8-21-13(18)9-20-10-14(19)22-15-11(16)6-5-7-12(15)17/h5-7H,2-4,8-10H2,1H3
- InChI Key
- RQLUHGKIMHFAAQ-UHFFFAOYSA-N
- Formula
- C15H18Cl2O5
- SMILES
-
CCCCCOC(=O)COCC(=O)Oc1c(Cl)ccc
c1Cl - Molecular Weight1
- 349.21
- 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° | -428.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -792.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.08 | kJ/mol | Joback Calculated Property |
| log10WS | -4.04 | Crippen Calculated Property | |
| logPoct/wat | 3.649 | Crippen Calculated Property | |
| McVol | 243.680 | ml/mol | McGowan Calculated Property |
| Pc | 1801.56 | kPa | Joback Calculated Property |
| Inp | [2861.00; 2861.00] |
|
|
| Inp | 2861.00 | NIST | |
| Inp | 2861.00 | NIST | |
| Tboil | 829.10 | K | Joback Calculated Property |
| Tc | 1040.04 | K | Joback Calculated Property |
| Tfus | 536.66 | K | Joback Calculated Property |
| Vc | 0.931 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [669.63; 726.60] | J/mol×K | [829.10; 1040.04] |
|
| Cp,gas | 669.63 | J/mol×K | 829.10 | Joback Calculated Property |
| Cp,gas | 681.71 | J/mol×K | 864.26 | Joback Calculated Property |
| Cp,gas | 692.77 | J/mol×K | 899.41 | Joback Calculated Property |
| Cp,gas | 702.79 | J/mol×K | 934.57 | Joback Calculated Property |
| Cp,gas | 711.77 | J/mol×K | 969.73 | Joback Calculated Property |
| Cp,gas | 719.71 | J/mol×K | 1004.89 | Joback Calculated Property |
| Cp,gas | 726.60 | J/mol×K | 1040.04 | Joback Calculated Property |
| η | [0.0000630; 0.0004117] | Pa×s | [536.66; 829.10] |
|
| η | 0.0004117 | Pa×s | 536.66 | Joback Calculated Property |
| η | 0.0002643 | Pa×s | 585.40 | Joback Calculated Property |
| η | 0.0001817 | Pa×s | 634.14 | Joback Calculated Property |
| η | 0.0001318 | Pa×s | 682.88 | Joback Calculated Property |
| η | 0.0000997 | Pa×s | 731.62 | Joback Calculated Property |
| η | 0.0000782 | Pa×s | 780.36 | Joback Calculated Property |
| η | 0.0000630 | Pa×s | 829.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diglycolic acid, 2,6-dichlorophenyl pentyl ester.
Sources
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