- InChI
- InChI=1S/C6H6O/c1-2-6-4-3-5-7-6/h2-5H,1H2
- InChI Key
- QQBUHYQVKJQAOB-UHFFFAOYSA-N
- Formula
- C6H6O
- SMILES
- C=Cc1ccco1
- Molecular Weight1
- 94.11
- CAS
- 1487-18-9
- Other Names
-
- 2-Ethenylfuran
- Furan, 2-ethenyl-
- Furylethylene
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°liquid : Liquid phase enthalpy of formation 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.
- I : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 | 0.2933 | Relay (1.0) Calculated Property | |
| ΔfG° | 71.70 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | 28.00 ± 4.00 | kJ/mol | NIST |
| ΔfH°liquid | -10.00 ± 3.00 | kJ/mol | NIST |
| ΔvapH° | [38.00; 38.00] | kJ/mol |
|
| ΔvapH° | 38.00 ± 1.00 | kJ/mol | NIST |
| ΔvapH° | 38.00 | kJ/mol | NIST |
| IE | 8.42 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.12 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.923 | Crippen Calculated Property | |
| McVol | 77.510 | ml/mol | McGowan Calculated Property |
| Pc | 4648.57 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [710.00; 765.00] |
|
|
| Inp | 725.00 | NIST | |
| Inp | 710.00 | NIST | |
| Inp | 724.00 | NIST | |
| Inp | 761.00 | NIST | |
| Inp | 723.00 | NIST | |
| Inp | 721.00 | NIST | |
| Inp | 713.00 | NIST | |
| Inp | 710.00 | NIST | |
| Inp | 765.00 | NIST | |
| Inp | 761.00 | NIST | |
| I | [1048.00; 1096.00] |
|
|
| I | 1085.00 | NIST | |
| I | 1075.00 | NIST | |
| I | 1048.00 | NIST | |
| I | 1051.00 | NIST | |
| I | 1051.00 | NIST | |
| I | 1053.00 | NIST | |
| I | 1053.00 | NIST | |
| I | 1054.00 | NIST | |
| I | 1058.00 | NIST | |
| I | 1090.00 | NIST | |
| I | 1096.00 | NIST | |
| I | 1075.00 | NIST | |
| I | 1075.00 | NIST | |
| I | 1063.00 | NIST | |
| I | 1082.00 | NIST | |
| I | 1075.00 | NIST | |
| I | 1058.00 | NIST | |
| I | 1063.00 | NIST | |
| I | 1085.00 | NIST | |
| I | 1051.00 | NIST | |
| Tboil | [372.00; 372.95] | K |
|
| Tboil | 372.70 | K | NIST |
| Tboil | 372.95 ± 1.50 | K | NIST |
| Tboil | 372.00 ± 4.00 | K | NIST |
| Tboil | 372.65 ± 2.00 | K | NIST |
| Tc | 582.95 | K | Relay (1.0) Calculated Property |
| Tfus | 179.15 ± 4.00 | K | NIST |
| Vc | 0.292 | m3/kmol | Relay (1.0) Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 292.20 | K | 2.30 | NIST |
Similar Compounds
Find more compounds similar to 2-Vinylfuran.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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