- InChI
- InChI=1S/C12H18O2/c1-4-10-8-7-9-11(13-5-2)12(10)14-6-3/h7-9H,4-6H2,1-3H3
- InChI Key
- FAZOHODJTTYSEH-UHFFFAOYSA-N
- Formula
- C12H18O2
- SMILES
- CCOc1cccc(CC)c1OCC
- Molecular Weight1
- 194.27
- CAS
- 131358-05-9
- Other Names
-
- Benzene, 1,2-diethoxy-3-ethyl
- 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 | 0.5918 | Relay (1.0) Calculated Property | |
| ΔfG° | -66.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -338.54 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.47 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.78 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.99 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.20 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.046 | Crippen Calculated Property | |
| McVol | 167.920 | ml/mol | McGowan Calculated Property |
| Pc | 2261.11 | kPa | Joback Calculated Property |
| Inp | [1384.00; 1384.00] |
|
|
| Inp | 1384.00 | NIST | |
| Inp | 1384.00 | NIST | |
| Tboil | 515.33 | K | Relay (1.0) Calculated Property |
| Tc | 721.90 | K | Relay (1.0) Calculated Property |
| Tfus | 253.71 | K | Relay (1.0) Calculated Property |
| Vc | 0.630 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [398.67; 481.59] | J/mol×K | [555.44; 753.59] |
|
| Cp,gas | 398.67 | J/mol×K | 555.44 | Joback Calculated Property |
| Cp,gas | 414.17 | J/mol×K | 588.47 | Joback Calculated Property |
| Cp,gas | 429.00 | J/mol×K | 621.49 | Joback Calculated Property |
| Cp,gas | 443.16 | J/mol×K | 654.52 | Joback Calculated Property |
| Cp,gas | 456.65 | J/mol×K | 687.54 | Joback Calculated Property |
| Cp,gas | 469.46 | J/mol×K | 720.57 | Joback Calculated Property |
| Cp,gas | 481.59 | J/mol×K | 753.59 | Joback Calculated Property |
| η | [0.0001336; 0.0011194] | Pa×s | [320.92; 555.44] |
|
| η | 0.0011194 | Pa×s | 320.92 | Joback Calculated Property |
| η | 0.0006481 | Pa×s | 360.01 | Joback Calculated Property |
| η | 0.0004176 | Pa×s | 399.09 | Joback Calculated Property |
| η | 0.0002910 | Pa×s | 438.18 | Joback Calculated Property |
| η | 0.0002152 | Pa×s | 477.27 | Joback Calculated Property |
| η | 0.0001666 | Pa×s | 516.35 | Joback Calculated Property |
| η | 0.0001336 | Pa×s | 555.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Diethoxy-3-ethylbenzene.
Sources
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