- InChI
- InChI=1S/C15H19ClO5/c1-5-15(6-2,13(16)17)14(18)21-12-10(19-3)8-7-9-11(12)20-4/h7-9H,5-6H2,1-4H3
- InChI Key
- SPKLDHKFKUDGKF-UHFFFAOYSA-N
- Formula
- C15H19ClO5
- SMILES
-
CCC(CC)(C(=O)Cl)C(=O)Oc1c(OC)c
ccc1OC - Molecular Weight1
- 314.76
- 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° | -413.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -785.65 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.39 | kJ/mol | Joback Calculated Property |
| log10WS | -3.80 | Crippen Calculated Property | |
| logPoct/wat | 3.181 | Crippen Calculated Property | |
| McVol | 231.440 | ml/mol | McGowan Calculated Property |
| Pc | 1890.36 | kPa | Joback Calculated Property |
| Inp | 2084.00 | NIST | |
| Tboil | 788.44 | K | Joback Calculated Property |
| Tc | 1003.86 | K | Joback Calculated Property |
| Tfus | 509.16 | K | Joback Calculated Property |
| Vc | 0.872 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [647.61; 712.71] | J/mol×K | [788.44; 1003.86] | 
|
| Cp,gas | 647.61 | J/mol×K | 788.44 | Joback Calculated Property |
| Cp,gas | 661.06 | J/mol×K | 824.34 | Joback Calculated Property |
| Cp,gas | 673.45 | J/mol×K | 860.25 | Joback Calculated Property |
| Cp,gas | 684.80 | J/mol×K | 896.15 | Joback Calculated Property |
| Cp,gas | 695.12 | J/mol×K | 932.05 | Joback Calculated Property |
| Cp,gas | 704.41 | J/mol×K | 967.96 | Joback Calculated Property |
| Cp,gas | 712.71 | J/mol×K | 1003.86 | Joback Calculated Property |
| η | [0.0000583; 0.0004457] | Pa×s | [509.16; 788.44] |
|
| η | 0.0004457 | Pa×s | 509.16 | Joback Calculated Property |
| η | 0.0002755 | Pa×s | 555.71 | Joback Calculated Property |
| η | 0.0001834 | Pa×s | 602.25 | Joback Calculated Property |
| η | 0.0001295 | Pa×s | 648.80 | Joback Calculated Property |
| η | 0.0000958 | Pa×s | 695.35 | Joback Calculated Property |
| η | 0.0000735 | Pa×s | 741.89 | Joback Calculated Property |
| η | 0.0000583 | Pa×s | 788.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, monochloride, 2,6-dimethoxyphenyl ester.
Sources
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