- InChI
- InChI=1S/C6H14O2/c1-3-6(2)8-5-4-7/h6-7H,3-5H2,1-2H3
- InChI Key
- HUWFDQSAXOIUNP-UHFFFAOYSA-N
- Formula
- C6H14O2
- SMILES
- CCC(C)OCCO
- Molecular Weight1
- 118.17
- CAS
- 7795-91-7
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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 | 0.6279 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -472.06 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.23 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.64 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 0.794 | Crippen Calculated Property | |
| McVol | 107.140 | ml/mol | McGowan Calculated Property |
| Pc | 3415.86 | kPa | Joback Calculated Property |
| Tboil | 439.01 | K | Relay (1.0) Calculated Property |
| Tc | 614.46 | K | Relay (1.0) Calculated Property |
| Tfus | 200.30 | K | Relay (1.0) Calculated Property |
| Vc | 0.383 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [230.39; 283.58] | J/mol×K | [451.04; 615.73] | 
|
| Cp,gas | 230.39 | J/mol×K | 451.04 | Joback Calculated Property |
| Cp,gas | 240.02 | J/mol×K | 478.49 | Joback Calculated Property |
| Cp,gas | 249.34 | J/mol×K | 505.94 | Joback Calculated Property |
| Cp,gas | 258.35 | J/mol×K | 533.38 | Joback Calculated Property |
| Cp,gas | 267.06 | J/mol×K | 560.83 | Joback Calculated Property |
| Cp,gas | 275.47 | J/mol×K | 588.28 | Joback Calculated Property |
| Cp,gas | 283.58 | J/mol×K | 615.73 | Joback Calculated Property |
| η | [0.0001817; 0.0820702] | Pa×s | [225.43; 451.04] |
|
| η | 0.0820702 | Pa×s | 225.43 | Joback Calculated Property |
| η | 0.0143045 | Pa×s | 263.03 | Joback Calculated Property |
| η | 0.0038597 | Pa×s | 300.63 | Joback Calculated Property |
| η | 0.0013936 | Pa×s | 338.24 | Joback Calculated Property |
| η | 0.0006169 | Pa×s | 375.84 | Joback Calculated Property |
| η | 0.0003167 | Pa×s | 413.44 | Joback Calculated Property |
| η | 0.0001817 | Pa×s | 451.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-(1-methylpropoxy)ethanol.
Sources
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