- InChI
- InChI=1S/C18H18O5/c1-2-21-17(19)15-10-6-7-11-16(15)18(20)23-13-12-22-14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3
- InChI Key
- GXXXPIOHYCMQNG-UHFFFAOYSA-N
- Formula
- C18H18O5
- SMILES
-
CCOC(=O)c1ccccc1C(=O)OCCOc1ccc
cc1 - Molecular Weight1
- 314.33
- 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° | -256.97 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -575.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.83 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.60 | kJ/mol | Joback Calculated Property |
| log10WS | -4.14 | Crippen Calculated Property | |
| logPoct/wat | 3.099 | Crippen Calculated Property | |
| McVol | 237.710 | ml/mol | McGowan Calculated Property |
| Pc | 2021.76 | kPa | Joback Calculated Property |
| Inp | [2786.00; 2786.00] |
|
|
| Inp | 2786.00 | NIST | |
| Inp | 2786.00 | NIST | |
| Tboil | 844.58 | K | Joback Calculated Property |
| Tc | 1071.29 | K | Joback Calculated Property |
| Tfus | 524.53 | K | Joback Calculated Property |
| Vc | 0.893 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [694.84; 755.59] | J/mol×K | [844.58; 1071.29] |
|
| Cp,gas | 694.84 | J/mol×K | 844.58 | Joback Calculated Property |
| Cp,gas | 708.18 | J/mol×K | 882.36 | Joback Calculated Property |
| Cp,gas | 720.21 | J/mol×K | 920.15 | Joback Calculated Property |
| Cp,gas | 730.95 | J/mol×K | 957.93 | Joback Calculated Property |
| Cp,gas | 740.42 | J/mol×K | 995.72 | Joback Calculated Property |
| Cp,gas | 748.63 | J/mol×K | 1033.50 | Joback Calculated Property |
| Cp,gas | 755.59 | J/mol×K | 1071.29 | Joback Calculated Property |
| η | [0.0000556; 0.0004449] | Pa×s | [524.53; 844.58] |
|
| η | 0.0004449 | Pa×s | 524.53 | Joback Calculated Property |
| η | 0.0002680 | Pa×s | 577.87 | Joback Calculated Property |
| η | 0.0001759 | Pa×s | 631.21 | Joback Calculated Property |
| η | 0.0001233 | Pa×s | 684.55 | Joback Calculated Property |
| η | 0.0000910 | Pa×s | 737.90 | Joback Calculated Property |
| η | 0.0000699 | Pa×s | 791.24 | Joback Calculated Property |
| η | 0.0000556 | Pa×s | 844.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phthalic acid, ethyl 2-phenoxyethyl ester.
Sources
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