- InChI
- InChI=1S/C14H18O6/c1-17-6-8-19-13(15)11-4-3-5-12(10-11)14(16)20-9-7-18-2/h3-5,10H,6-9H2,1-2H3
- InChI Key
- YSSDTDBYYWDTCN-UHFFFAOYSA-N
- Formula
- C14H18O6
- SMILES
- COCCOC(=O)c1cccc(C(=O)OCCOC)c1
- Molecular Weight1
- 282.29
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8671 | Relay (... Calculated Property | |
| ΔfG° | -508.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -939.49 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 33.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.30 | kJ/mol | Relay (... Calculated Property |
| IE | 9.20 | eV | Relay (... Calculated Property |
| log10WS | -2.55 | Relay (... Calculated Property | |
| logPoct/wat | 1.293 | Crippen Calculated Property | |
| McVol | 210.980 | ml/mol | McGowan Calculated Property |
| Pc | 2088.84 | kPa | Joback Calculated Property |
| Inp | [2154.00; 2154.00] |
|
|
| Inp | 2154.00 | NIST | |
| Inp | 2154.00 | NIST | |
| Tboil | 619.16 | K | Relay (... Calculated Property |
| Tc | 807.05 | K | Relay (... Calculated Property |
| Tfus | 298.61 | K | Relay (... Calculated Property |
| Vc | 0.783 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [593.40; 661.35] | J/mol×K | [748.80; 952.07] |
|
| Cp,gas | 593.40 | J/mol×K | 748.80 | Joback Calculated Property |
| Cp,gas | 607.15 | J/mol×K | 782.68 | Joback Calculated Property |
| Cp,gas | 619.95 | J/mol×K | 816.56 | Joback Calculated Property |
| Cp,gas | 631.79 | J/mol×K | 850.44 | Joback Calculated Property |
| Cp,gas | 642.65 | J/mol×K | 884.31 | Joback Calculated Property |
| Cp,gas | 652.51 | J/mol×K | 918.19 | Joback Calculated Property |
| Cp,gas | 661.35 | J/mol×K | 952.07 | Joback Calculated Property |
| η | [0.0000705; 0.0005167] | Pa×s | [475.26; 748.80] |
|
| η | 0.0005167 | Pa×s | 475.26 | Joback Calculated Property |
| η | 0.0003206 | Pa×s | 520.85 | Joback Calculated Property |
| η | 0.0002148 | Pa×s | 566.44 | Joback Calculated Property |
| η | 0.0001528 | Pa×s | 612.03 | Joback Calculated Property |
| η | 0.0001139 | Pa×s | 657.62 | Joback Calculated Property |
| η | 0.0000882 | Pa×s | 703.21 | Joback Calculated Property |
| η | 0.0000705 | Pa×s | 748.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, di(2-methoxyethyl) ester.
Sources
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