- InChI
- InChI=1S/C16H14O4/c17-15(13-7-3-1-4-8-13)19-11-12-20-16(18)14-9-5-2-6-10-14/h1-10H,11-12H2
- InChI Key
- XFDQLDNQZFOAFK-UHFFFAOYSA-N
- Formula
- C16H14O4
- SMILES
- O=C(OCCOC(=O)c1ccccc1)c1ccccc1
- Molecular Weight1
- 270.28
- CAS
- 94-49-5
- Other Names
-
- Ethylene glycol, dibenzoate
- Benzoflex e-60
- Benzoflex 998
- Dibenzoyl ethylene glycol
- Ethylene dibenzoate
- Glycol dibenzoate
- Polyethylene-glycol (200) dibenzoate
- 2-(Benzoyloxy)ethyl benzoate
- 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° | -159.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -390.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.07 | kJ/mol | Joback Calculated Property |
| log10WS | -3.61 | Crippen Calculated Property | |
| logPoct/wat | 2.700 | Crippen Calculated Property | |
| McVol | 203.660 | ml/mol | McGowan Calculated Property |
| Pc | 2500.00 | kPa | Joback Calculated Property |
| Inp | [2108.00; 2108.00] |
|
|
| Inp | 2108.00 | NIST | |
| Inp | 2108.00 | NIST | |
| Tboil | 771.42 | K | Joback Calculated Property |
| Tc | 1006.54 | K | Joback Calculated Property |
| Tfus | 467.24 | K | Joback Calculated Property |
| Vc | 0.763 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [559.80; 624.01] | J/mol×K | [771.42; 1006.54] |
|
| Cp,gas | 559.80 | J/mol×K | 771.42 | Joback Calculated Property |
| Cp,gas | 573.45 | J/mol×K | 810.61 | Joback Calculated Property |
| Cp,gas | 585.87 | J/mol×K | 849.79 | Joback Calculated Property |
| Cp,gas | 597.10 | J/mol×K | 888.98 | Joback Calculated Property |
| Cp,gas | 607.18 | J/mol×K | 928.17 | Joback Calculated Property |
| Cp,gas | 616.14 | J/mol×K | 967.36 | Joback Calculated Property |
| Cp,gas | 624.01 | J/mol×K | 1006.54 | Joback Calculated Property |
| η | [0.0000941; 0.0008585] | Pa×s | [467.24; 771.42] |
|
| η | 0.0008585 | Pa×s | 467.24 | Joback Calculated Property |
| η | 0.0004959 | Pa×s | 517.94 | Joback Calculated Property |
| η | 0.0003158 | Pa×s | 568.63 | Joback Calculated Property |
| η | 0.0002166 | Pa×s | 619.33 | Joback Calculated Property |
| η | 0.0001573 | Pa×s | 670.03 | Joback Calculated Property |
| η | 0.0001194 | Pa×s | 720.72 | Joback Calculated Property |
| η | 0.0000941 | Pa×s | 771.42 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Ethanediol, dibenzoate.
Sources
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