- InChI
- InChI=1S/C8H14O/c1-4-8(3)6-5-7(2)9-8/h4,7H,1,5-6H2,2-3H3
- InChI Key
- UZNFMVFUQYWYET-UHFFFAOYSA-N
- Formula
- C8H14O
- SMILES
- C=CC1(C)CCC(C)O1
- Molecular Weight1
- 126.20
- 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).
- I : 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 | 0.2710 | Relay (1.0) Calculated Property | |
| ΔfG° | 41.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -172.30 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 11.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.63 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.05 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.87 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.130 | Crippen Calculated Property | |
| McVol | 114.290 | ml/mol | McGowan Calculated Property |
| Pc | 3224.64 | kPa | Joback Calculated Property |
| I | [1639.00; 1639.00] |
|
|
| I | 1639.00 | NIST | |
| I | 1639.00 | NIST | |
| I | 1639.00 | NIST | |
| I | 1639.00 | NIST | |
| Tboil | 397.83 | K | Relay (1.0) Calculated Property |
| Tc | 586.72 | K | Relay (1.0) Calculated Property |
| Tfus | 158.95 | K | Relay (1.0) Calculated Property |
| Vc | 0.416 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [230.81; 313.65] | J/mol×K | [416.92; 622.80] |
|
| Cp,gas | 230.81 | J/mol×K | 416.92 | Joback Calculated Property |
| Cp,gas | 247.12 | J/mol×K | 451.23 | Joback Calculated Property |
| Cp,gas | 262.30 | J/mol×K | 485.55 | Joback Calculated Property |
| Cp,gas | 276.45 | J/mol×K | 519.86 | Joback Calculated Property |
| Cp,gas | 289.66 | J/mol×K | 554.17 | Joback Calculated Property |
| Cp,gas | 302.03 | J/mol×K | 588.49 | Joback Calculated Property |
| Cp,gas | 313.65 | J/mol×K | 622.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-Methyl-5-ethenyldihydro-2(3H)-furanone.
Sources
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