- InChI
- InChI=1S/C15H12Cl2O2/c1-19-15(18)14(10-2-6-12(16)7-3-10)11-4-8-13(17)9-5-11/h2-9,14H,1H3
- InChI Key
- FIHLIVMWNUSLRU-UHFFFAOYSA-N
- Formula
- C15H12Cl2O2
- SMILES
-
COC(=O)C(c1ccc(Cl)cc1)c1ccc(Cl
)cc1 - Molecular Weight1
- 295.16
- CAS
- 5359-38-6
- Other Names
-
- p,p'-DDA methyl ester
- Methyl bis(p-chlorophenyl)acetate
- methyl bis(4-chlorophenyl)ethanoate
- 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° | 20.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -184.37 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.40 | kJ/mol | Joback Calculated Property |
| log10WS | -4.61 | Crippen Calculated Property | |
| logPoct/wat | 4.298 | Crippen Calculated Property | |
| McVol | 206.610 | ml/mol | McGowan Calculated Property |
| Pc | 2388.85 | kPa | Joback Calculated Property |
| Inp | [2085.00; 2085.00] |
|
|
| Inp | 2085.00 | NIST | |
| Inp | 2085.00 | NIST | |
| Tboil | 756.63 | K | Joback Calculated Property |
| Tc | 1005.36 | K | Joback Calculated Property |
| Tfus | 312.00 ± 0.20 | K | NIST |
| Vc | 0.775 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [513.89; 575.60] | J/mol×K | [756.63; 1005.36] |
|
| Cp,gas | 513.89 | J/mol×K | 756.63 | Joback Calculated Property |
| Cp,gas | 526.94 | J/mol×K | 798.09 | Joback Calculated Property |
| Cp,gas | 538.82 | J/mol×K | 839.54 | Joback Calculated Property |
| Cp,gas | 549.57 | J/mol×K | 881.00 | Joback Calculated Property |
| Cp,gas | 559.25 | J/mol×K | 922.45 | Joback Calculated Property |
| Cp,gas | 567.91 | J/mol×K | 963.91 | Joback Calculated Property |
| Cp,gas | 575.60 | J/mol×K | 1005.36 | Joback Calculated Property |
| η | [0.0001053; 0.0009034] | Pa×s | [453.69; 756.63] |
|
| η | 0.0009034 | Pa×s | 453.69 | Joback Calculated Property |
| η | 0.0005277 | Pa×s | 504.18 | Joback Calculated Property |
| η | 0.0003399 | Pa×s | 554.67 | Joback Calculated Property |
| η | 0.0002356 | Pa×s | 605.16 | Joback Calculated Property |
| η | 0.0001728 | Pa×s | 655.65 | Joback Calculated Property |
| η | 0.0001325 | Pa×s | 706.14 | Joback Calculated Property |
| η | 0.0001053 | Pa×s | 756.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to DDA Methyl ester.
Sources
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