- InChI
- InChI=1S/C15H20O4/c1-11(2)10-18-13(16)15(3,4)14(17)19-12-8-6-5-7-9-12/h5-9,11H,10H2,1-4H3
- InChI Key
- PTNQZRSTMUZPTH-UHFFFAOYSA-N
- Formula
- C15H20O4
- SMILES
-
CC(C)COC(=O)C(C)(C)C(=O)Oc1ccc
cc1 - Molecular Weight1
- 264.32
- 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° | -279.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -620.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.89 | kJ/mol | Joback Calculated Property |
| log10WS | -3.09 | Crippen Calculated Property | |
| logPoct/wat | 2.817 | Crippen Calculated Property | |
| McVol | 213.330 | ml/mol | McGowan Calculated Property |
| Pc | 2051.17 | kPa | Joback Calculated Property |
| Inp | [1680.00; 1680.00] |
|
|
| Inp | 1680.00 | NIST | |
| Inp | 1680.00 | NIST | |
| Tboil | 718.19 | K | Joback Calculated Property |
| Tc | 934.22 | K | Joback Calculated Property |
| Tfus | 416.97 | K | Joback Calculated Property |
| Vc | 0.798 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [597.44; 675.06] | J/mol×K | [718.19; 934.22] |
|
| Cp,gas | 597.44 | J/mol×K | 718.19 | Joback Calculated Property |
| Cp,gas | 613.04 | J/mol×K | 754.20 | Joback Calculated Property |
| Cp,gas | 627.52 | J/mol×K | 790.20 | Joback Calculated Property |
| Cp,gas | 640.93 | J/mol×K | 826.21 | Joback Calculated Property |
| Cp,gas | 653.29 | J/mol×K | 862.21 | Joback Calculated Property |
| Cp,gas | 664.66 | J/mol×K | 898.22 | Joback Calculated Property |
| Cp,gas | 675.06 | J/mol×K | 934.22 | Joback Calculated Property |
| η | [0.0000813; 0.0013204] | Pa×s | [416.97; 718.19] |
|
| η | 0.0013204 | Pa×s | 416.97 | Joback Calculated Property |
| η | 0.0006464 | Pa×s | 467.17 | Joback Calculated Property |
| η | 0.0003635 | Pa×s | 517.38 | Joback Calculated Property |
| η | 0.0002264 | Pa×s | 567.58 | Joback Calculated Property |
| η | 0.0001522 | Pa×s | 617.78 | Joback Calculated Property |
| η | 0.0001087 | Pa×s | 667.99 | Joback Calculated Property |
| η | 0.0000813 | Pa×s | 718.19 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, isobutyl phenyl ester.
Sources
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