- InChI
- InChI=1S/C8H16O/c1-7(2,3)6-8(4,5)9-6/h6H,1-5H3
- InChI Key
- OUYYZNFRPHQCIM-UHFFFAOYSA-N
- Formula
- C8H16O
- SMILES
- CC(C)(C)C1OC1(C)C
- Molecular Weight1
- 128.21
- CAS
- 96-06-0
- 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 | 0.3280 | Relay (... Calculated Property | |
| ΔfG° | -19.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -236.27 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 9.95 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.73 | kJ/mol | Relay (... Calculated Property |
| IE | 9.29 | eV | Relay (... Calculated Property |
| log10WS | -2.25 | Relay (... Calculated Property | |
| logPoct/wat | 2.210 | Crippen Calculated Property | |
| McVol | 118.590 | ml/mol | McGowan Calculated Property |
| Pc | 2973.04 | kPa | Joback Calculated Property |
| Tboil | 393.76 | K | Relay (... Calculated Property |
| Tc | 590.60 | K | Relay (... Calculated Property |
| Tfus | 249.27 | K | Relay (... Calculated Property |
| Vc | 0.437 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [250.25; 333.80] | J/mol×K | [408.47; 606.86] | 
|
| Cp,gas | 250.25 | J/mol×K | 408.47 | Joback Calculated Property |
| Cp,gas | 266.99 | J/mol×K | 441.53 | Joback Calculated Property |
| Cp,gas | 282.45 | J/mol×K | 474.60 | Joback Calculated Property |
| Cp,gas | 296.75 | J/mol×K | 507.66 | Joback Calculated Property |
| Cp,gas | 310.00 | J/mol×K | 540.73 | Joback Calculated Property |
| Cp,gas | 322.31 | J/mol×K | 573.79 | Joback Calculated Property |
| Cp,gas | 333.80 | J/mol×K | 606.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,3-Epoxy-2,4,4-trimethyl pentane.
Sources
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