- InChI
- InChI=1S/C15H19ClO3/c1-5-15(6-2,13(16)17)14(18)19-12-9-7-8-10(3)11(12)4/h7-9H,5-6H2,1-4H3
- InChI Key
- MCROHUZXPLHPEK-UHFFFAOYSA-N
- Formula
- C15H19ClO3
- SMILES
-
CCC(CC)(C(=O)Cl)C(=O)Oc1cccc(C
)c1C - Molecular Weight1
- 282.76
- 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° | -203.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -521.21 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.58 | kJ/mol | Joback Calculated Property |
| log10WS | -4.52 | Crippen Calculated Property | |
| logPoct/wat | 3.781 | Crippen Calculated Property | |
| McVol | 219.700 | ml/mol | McGowan Calculated Property |
| Pc | 1947.51 | kPa | Joback Calculated Property |
| Inp | 1883.00 | NIST | |
| Tboil | 743.60 | K | Joback Calculated Property |
| Tc | 962.75 | K | Joback Calculated Property |
| Tfus | 464.70 | K | Joback Calculated Property |
| Vc | 0.836 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [594.63; 665.85] | J/mol×K | [743.60; 962.75] | 
|
| Cp,gas | 594.63 | J/mol×K | 743.60 | Joback Calculated Property |
| Cp,gas | 608.88 | J/mol×K | 780.13 | Joback Calculated Property |
| Cp,gas | 622.13 | J/mol×K | 816.65 | Joback Calculated Property |
| Cp,gas | 634.40 | J/mol×K | 853.18 | Joback Calculated Property |
| Cp,gas | 645.75 | J/mol×K | 889.70 | Joback Calculated Property |
| Cp,gas | 656.22 | J/mol×K | 926.23 | Joback Calculated Property |
| Cp,gas | 665.85 | J/mol×K | 962.75 | Joback Calculated Property |
| η | [0.0001020; 0.0008875] | Pa×s | [464.70; 743.60] |
|
| η | 0.0008875 | Pa×s | 464.70 | Joback Calculated Property |
| η | 0.0005253 | Pa×s | 511.18 | Joback Calculated Property |
| η | 0.0003393 | Pa×s | 557.67 | Joback Calculated Property |
| η | 0.0002344 | Pa×s | 604.15 | Joback Calculated Property |
| η | 0.0001708 | Pa×s | 650.63 | Joback Calculated Property |
| η | 0.0001298 | Pa×s | 697.12 | Joback Calculated Property |
| η | 0.0001020 | Pa×s | 743.60 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, monochloride, 2,3-dimethylphenyl ester.
Sources
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