- InChI
- InChI=1S/C6H12O/c1-5(2)3-6-4-7-6/h5-6H,3-4H2,1-2H3
- InChI Key
- YXIOECOAAMLHPG-UHFFFAOYSA-N
- Formula
- C6H12O
- SMILES
- CC(C)CC1CO1
- Molecular Weight1
- 100.16
- CAS
- 23850-78-4
- Other Names
-
- Pentane, 1,2-epoxy-4-methyl-
- 1,2-Epoxy-4-methylpentane
- 2-Isobutyloxirane
- 4-Methyl-1,2-epoxypentane
- Isobutyloxirane
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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 |
|---|---|---|---|
| ω | 0.3480 | Relay (1.0) Calculated Property | |
| ΔfG° | -28.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -171.50 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.89 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.50 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.98 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.70 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.431 | Crippen Calculated Property | |
| McVol | 90.410 | ml/mol | McGowan Calculated Property |
| Pc | 3607.21 | kPa | Joback Calculated Property |
| Inp | [721.00; 753.40] |
|
|
| Inp | 751.20 | NIST | |
| Inp | 751.80 | NIST | |
| Inp | 753.40 | NIST | |
| Inp | 753.40 | NIST | |
| Inp | 721.00 | NIST | |
| Inp | 721.00 | NIST | |
| Tboil | 382.45 | K | Relay (1.0) Calculated Property |
| Tc | 556.81 | K | Relay (1.0) Calculated Property |
| Tfus | 179.73 | K | Relay (1.0) Calculated Property |
| Vc | 0.350 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [169.54; 234.50] | J/mol×K | [369.93; 554.59] |
|
| Cp,gas | 169.54 | J/mol×K | 369.93 | Joback Calculated Property |
| Cp,gas | 181.85 | J/mol×K | 400.71 | Joback Calculated Property |
| Cp,gas | 193.53 | J/mol×K | 431.48 | Joback Calculated Property |
| Cp,gas | 204.61 | J/mol×K | 462.26 | Joback Calculated Property |
| Cp,gas | 215.11 | J/mol×K | 493.03 | Joback Calculated Property |
| Cp,gas | 225.07 | J/mol×K | 523.81 | Joback Calculated Property |
| Cp,gas | 234.50 | J/mol×K | 554.59 | Joback Calculated Property |
| η | [0.0003867; 0.0020193] | Pa×s | [186.89; 369.93] |
|
| η | 0.0020193 | Pa×s | 186.89 | Joback Calculated Property |
| η | 0.0012637 | Pa×s | 217.40 | Joback Calculated Property |
| η | 0.0008875 | Pa×s | 247.90 | Joback Calculated Property |
| η | 0.0006735 | Pa×s | 278.41 | Joback Calculated Property |
| η | 0.0005397 | Pa×s | 308.92 | Joback Calculated Property |
| η | 0.0004501 | Pa×s | 339.42 | Joback Calculated Property |
| η | 0.0003867 | Pa×s | 369.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Oxirane, (2-methylpropyl)-.
Sources
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