- InChI
- InChI=1S/C8H12O/c1-2-7-5-3-4-6-8(7)9/h2H,3-6H2,1H3/b7-2-
- InChI Key
- YPRIHWWNQRSAQL-UQCOIBPSSA-N
- Formula
- C8H12O
- SMILES
- CC=C1CCCCC1=O
- Molecular Weight1
- 124.18
- CAS
- 1122-24-3
- Other Names
-
- 2-Ethylidenecyclohexanone (c,t)
- ω : Acentric Factor.
- 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).
- 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).
- 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 | 0.3366 | Relay (... Calculated Property | |
| ΔfG° | -28.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -160.67 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 7.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.46 | kJ/mol | Relay (... Calculated Property |
| IE | 9.03 | eV | Relay (... Calculated Property |
| log10WS | -1.50 | Relay (... Calculated Property | |
| logPoct/wat | 2.076 | Crippen Calculated Property | |
| McVol | 109.990 | ml/mol | McGowan Calculated Property |
| Pc | 3526.27 | kPa | Joback Calculated Property |
| Tboil | 472.98 | K | Relay (... Calculated Property |
| Tc | 699.82 | K | Relay (... Calculated Property |
| Tfus | 244.07 | K | Relay (... Calculated Property |
| Vc | 0.365 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [230.37; 311.05] | J/mol×K | [481.12; 709.80] | 
|
| Cp,gas | 230.37 | J/mol×K | 481.12 | Joback Calculated Property |
| Cp,gas | 245.68 | J/mol×K | 519.23 | Joback Calculated Property |
| Cp,gas | 260.23 | J/mol×K | 557.35 | Joback Calculated Property |
| Cp,gas | 274.04 | J/mol×K | 595.46 | Joback Calculated Property |
| Cp,gas | 287.11 | J/mol×K | 633.57 | Joback Calculated Property |
| Cp,gas | 299.45 | J/mol×K | 671.69 | Joback Calculated Property |
| Cp,gas | 311.05 | J/mol×K | 709.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Ethylidenecyclohexanone.
Sources
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