- InChI
- InChI=1S/C15H27ClO3/c1-7-15(8-2,12(16)17)13(18)19-10-11(3)9-14(4,5)6/h11H,7-10H2,1-6H3
- InChI Key
- BFCBLBSMZGPTHY-UHFFFAOYSA-N
- Formula
- C15H27ClO3
- SMILES
-
CCC(CC)(C(=O)Cl)C(=O)OCC(C)CC(
C)(C)C - Molecular Weight1
- 290.83
- 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° | -296.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -748.83 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.84 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.29 | kJ/mol | Joback Calculated Property |
| log10WS | -4.17 | Crippen Calculated Property | |
| logPoct/wat | 4.174 | Crippen Calculated Property | |
| McVol | 243.460 | ml/mol | McGowan Calculated Property |
| Pc | 1550.00 | kPa | Joback Calculated Property |
| Inp | 1583.00 | NIST | |
| Tboil | 703.29 | K | Joback Calculated Property |
| Tc | 900.49 | K | Joback Calculated Property |
| Tfus | 400.66 | K | Joback Calculated Property |
| Vc | 0.926 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [684.49; 769.47] | J/mol×K | [703.29; 900.49] | 
|
| Cp,gas | 684.49 | J/mol×K | 703.29 | Joback Calculated Property |
| Cp,gas | 701.00 | J/mol×K | 736.16 | Joback Calculated Property |
| Cp,gas | 716.50 | J/mol×K | 769.02 | Joback Calculated Property |
| Cp,gas | 731.04 | J/mol×K | 801.89 | Joback Calculated Property |
| Cp,gas | 744.68 | J/mol×K | 834.76 | Joback Calculated Property |
| Cp,gas | 757.48 | J/mol×K | 867.62 | Joback Calculated Property |
| Cp,gas | 769.47 | J/mol×K | 900.49 | Joback Calculated Property |
| η | [0.0000800; 0.0020665] | Pa×s | [400.66; 703.29] |
|
| η | 0.0020665 | Pa×s | 400.66 | Joback Calculated Property |
| η | 0.0008878 | Pa×s | 451.10 | Joback Calculated Property |
| η | 0.0004520 | Pa×s | 501.54 | Joback Calculated Property |
| η | 0.0002604 | Pa×s | 551.97 | Joback Calculated Property |
| η | 0.0001645 | Pa×s | 602.41 | Joback Calculated Property |
| η | 0.0001116 | Pa×s | 652.85 | Joback Calculated Property |
| η | 0.0000800 | Pa×s | 703.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, monochloride, 2,4,4-trimethylpentyl ester.
Sources
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