- InChI
- InChI=1S/C6H12O/c1-4-5-6(2,3)7-5/h5H,4H2,1-3H3
- InChI Key
- OZVWXRGXOYUQEJ-UHFFFAOYSA-N
- Formula
- C6H12O
- SMILES
- CCC1OC1(C)C
- Molecular Weight1
- 100.16
- CAS
- 1192-22-9
- Other Names
-
- Pentane, 2,3-epoxy-2-methyl-
- 2-Methyl-2-pentene oxide
- 2,3-Epoxy-2-methylpentane
- 2-Methyl-2,3-pentylene oxide
- 2-Methyl-2,3-epoxypentane
- 3-Ethyl-2,2-dimethyl oxirane
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- Inp : Non-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 |
|---|---|---|---|
| ΔfG° | -38.93 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -231.47 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 12.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 31.91 | kJ/mol | Joback Calculated Property |
| log10WS | -1.54 | Crippen Calculated Property | |
| logPoct/wat | 1.574 | Crippen Calculated Property | |
| McVol | 90.410 | ml/mol | McGowan Calculated Property |
| Pc | 3624.61 | kPa | Joback Calculated Property |
| Inp | [700.30; 707.00] |
|
|
| Inp | 700.30 | NIST | |
| Inp | 700.60 | NIST | |
| Inp | 701.40 | NIST | |
| Inp | 701.40 | NIST | |
| Inp | Outlier 707.00 | NIST | |
| Inp | 700.30 | NIST | |
| Tboil | 365.94 | K | Joback Calculated Property |
| Tc | 553.87 | K | Joback Calculated Property |
| Tfus | 221.55 | K | Joback Calculated Property |
| Vc | 0.346 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [170.26; 236.18] | J/mol×K | [365.94; 553.87] |
|
| Cp,gas | 170.26 | J/mol×K | 365.94 | Joback Calculated Property |
| Cp,gas | 183.37 | J/mol×K | 397.26 | Joback Calculated Property |
| Cp,gas | 195.52 | J/mol×K | 428.58 | Joback Calculated Property |
| Cp,gas | 206.80 | J/mol×K | 459.90 | Joback Calculated Property |
| Cp,gas | 217.29 | J/mol×K | 491.22 | Joback Calculated Property |
| Cp,gas | 227.05 | J/mol×K | 522.54 | Joback Calculated Property |
| Cp,gas | 236.18 | J/mol×K | 553.87 | Joback Calculated Property |
| ΔvapH | 40.60 | kJ/mol | 337.50 | NIST |
Similar Compounds
Find more compounds similar to Oxirane, 3-ethyl-2,2-dimethyl-.
Sources
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Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.