- InChI
- InChI=1S/C10H11NO/c1-2-12-10-6-4-3-5-9(10)7-8-11/h3-6H,2,7H2,1H3
- InChI Key
- XXLCVIZGVFWXFL-UHFFFAOYSA-N
- Formula
- C10H11NO
- SMILES
- CCOc1ccccc1CC#N
- Molecular Weight1
- 161.20
- CAS
- 74205-51-9
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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° | 164.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 7.99 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.68 | kJ/mol | Joback Calculated Property |
| log10WS | -2.68 | Crippen Calculated Property | |
| logPoct/wat | 2.151 | Crippen Calculated Property | |
| McVol | 135.250 | ml/mol | McGowan Calculated Property |
| Pc | 2758.46 | kPa | Joback Calculated Property |
| Tboil | 584.36 | K | Joback Calculated Property |
| Tc | 805.88 | K | Joback Calculated Property |
| Tfus | 328.62 | K | Joback Calculated Property |
| Vc | 0.531 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [310.69; 372.76] | J/mol×K | [584.36; 805.88] | 
|
| Cp,gas | 310.69 | J/mol×K | 584.36 | Joback Calculated Property |
| Cp,gas | 322.72 | J/mol×K | 621.28 | Joback Calculated Property |
| Cp,gas | 334.06 | J/mol×K | 658.20 | Joback Calculated Property |
| Cp,gas | 344.72 | J/mol×K | 695.12 | Joback Calculated Property |
| Cp,gas | 354.71 | J/mol×K | 732.04 | Joback Calculated Property |
| Cp,gas | 364.05 | J/mol×K | 768.96 | Joback Calculated Property |
| Cp,gas | 372.76 | J/mol×K | 805.88 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Ethoxyphenylacetonitrile.
Sources
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