- InChI
- InChI=1S/C19H22O4/c1-4-11-22-17(20)19(2,3)18(21)23-13-14-9-10-15-7-5-6-8-16(15)12-14/h5-10,12H,4,11,13H2,1-3H3
- InChI Key
- XMMQASJHRMLRBX-UHFFFAOYSA-N
- Formula
- C19H22O4
- SMILES
-
CCCOC(=O)C(C)(C)C(=O)OCc1ccc2c
cccc2c1 - Molecular Weight1
- 314.38
- 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° | -146.47 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -517.71 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.80 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.48 | kJ/mol | Joback Calculated Property |
| log10WS | -4.99 | Crippen Calculated Property | |
| logPoct/wat | 3.862 | Crippen Calculated Property | |
| McVol | 250.230 | ml/mol | McGowan Calculated Property |
| Pc | 1780.34 | kPa | Joback Calculated Property |
| Inp | [2366.00; 2366.00] |
|
|
| Inp | 2366.00 | NIST | |
| Inp | 2366.00 | NIST | |
| Tboil | 834.11 | K | Joback Calculated Property |
| Tc | 1057.24 | K | Joback Calculated Property |
| Tfus | 522.27 | K | Joback Calculated Property |
| Vc | 0.951 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [746.82; 819.17] | J/mol×K | [834.11; 1057.24] |
|
| Cp,gas | 746.82 | J/mol×K | 834.11 | Joback Calculated Property |
| Cp,gas | 761.35 | J/mol×K | 871.30 | Joback Calculated Property |
| Cp,gas | 774.80 | J/mol×K | 908.49 | Joback Calculated Property |
| Cp,gas | 787.23 | J/mol×K | 945.67 | Joback Calculated Property |
| Cp,gas | 798.71 | J/mol×K | 982.86 | Joback Calculated Property |
| Cp,gas | 809.34 | J/mol×K | 1020.05 | Joback Calculated Property |
| Cp,gas | 819.17 | J/mol×K | 1057.24 | Joback Calculated Property |
| η | [0.0000973; 0.0007020] | Pa×s | [522.27; 834.11] |
|
| η | 0.0007020 | Pa×s | 522.27 | Joback Calculated Property |
| η | 0.0004351 | Pa×s | 574.24 | Joback Calculated Property |
| η | 0.0002919 | Pa×s | 626.22 | Joback Calculated Property |
| η | 0.0002082 | Pa×s | 678.19 | Joback Calculated Property |
| η | 0.0001558 | Pa×s | 730.16 | Joback Calculated Property |
| η | 0.0001212 | Pa×s | 782.14 | Joback Calculated Property |
| η | 0.0000973 | Pa×s | 834.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, 2-naphthylmethyl propyl ester.
Sources
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