- InChI
- InChI=1S/C12H26O/c1-5-6-7-8-9-10-11-13-12(2,3)4/h5-11H2,1-4H3
- InChI Key
- DXJWXUJMLBHMHP-UHFFFAOYSA-N
- Formula
- C12H26O
- SMILES
- CCCCCCCCOC(C)(C)C
- Molecular Weight1
- 186.33
- CAS
- 51323-70-7
- 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).
- 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 | 0.5577 | Relay (1.0) Calculated Property | |
| ΔfG° | -52.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -439.01 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 20.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.40 | kJ/mol | NIST |
| IE | 9.18 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.25 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.162 | Crippen Calculated Property | |
| McVol | 185.810 | ml/mol | McGowan Calculated Property |
| Pc | 1783.35 | kPa | Joback Calculated Property |
| Tboil | 474.06 | K | Relay (1.0) Calculated Property |
| Tc | 639.10 | K | Relay (1.0) Calculated Property |
| Tfus | 212.60 | K | Relay (1.0) Calculated Property |
| Vc | 0.722 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [438.19; 533.19] | J/mol×K | [493.35; 663.33] | 
|
| Cp,gas | 438.19 | J/mol×K | 493.35 | Joback Calculated Property |
| Cp,gas | 455.79 | J/mol×K | 521.68 | Joback Calculated Property |
| Cp,gas | 472.65 | J/mol×K | 550.01 | Joback Calculated Property |
| Cp,gas | 488.81 | J/mol×K | 578.34 | Joback Calculated Property |
| Cp,gas | 504.27 | J/mol×K | 606.67 | Joback Calculated Property |
| Cp,gas | 519.05 | J/mol×K | 635.00 | Joback Calculated Property |
| Cp,gas | 533.19 | J/mol×K | 663.33 | Joback Calculated Property |
| η | [0.0001720; 0.0060945] | Pa×s | [249.65; 493.35] |
|
| η | 0.0060945 | Pa×s | 249.65 | Joback Calculated Property |
| η | 0.0022185 | Pa×s | 290.27 | Joback Calculated Property |
| η | 0.0010349 | Pa×s | 330.88 | Joback Calculated Property |
| η | 0.0005704 | Pa×s | 371.50 | Joback Calculated Property |
| η | 0.0003536 | Pa×s | 412.12 | Joback Calculated Property |
| η | 0.0002388 | Pa×s | 452.73 | Joback Calculated Property |
| η | 0.0001720 | Pa×s | 493.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Octyl tert-butyl ether.
Sources
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