- InChI
- InChI=1S/C12H26O/c1-5-7-8-9-10-11-13-12(3,4)6-2/h5-11H2,1-4H3
- InChI Key
- SHGLLHAAYXCZQW-UHFFFAOYSA-N
- Formula
- C12H26O
- SMILES
- CCCCCCCOC(C)(C)CC
- Molecular Weight1
- 186.33
- 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).
- 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° | -52.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -431.98 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.42 | kJ/mol | Joback Calculated Property |
| log10WS | -4.04 | Crippen Calculated Property | |
| logPoct/wat | 4.162 | Crippen Calculated Property | |
| McVol | 185.810 | ml/mol | McGowan Calculated Property |
| Pc | 1783.35 | kPa | Joback Calculated Property |
| Inp | 1101.00 | NIST | |
| Tboil | 493.15 | K | Joback Calculated Property |
| Tc | 663.06 | K | Joback Calculated Property |
| Tfus | 249.65 | K | Joback Calculated Property |
| Vc | 0.715 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [438.06; 533.06] | J/mol×K | [493.15; 663.06] | 
|
| Cp,gas | 438.06 | J/mol×K | 493.15 | Joback Calculated Property |
| Cp,gas | 455.66 | J/mol×K | 521.47 | Joback Calculated Property |
| Cp,gas | 472.52 | J/mol×K | 549.79 | Joback Calculated Property |
| Cp,gas | 488.68 | J/mol×K | 578.11 | Joback Calculated Property |
| Cp,gas | 504.13 | J/mol×K | 606.43 | Joback Calculated Property |
| Cp,gas | 518.92 | J/mol×K | 634.75 | Joback Calculated Property |
| Cp,gas | 533.06 | J/mol×K | 663.06 | Joback Calculated Property |
| η | [0.0001723; 0.0060945] | Pa×s | [249.65; 493.15] |
|
| η | 0.0060945 | Pa×s | 249.65 | Joback Calculated Property |
| η | 0.0022201 | Pa×s | 290.23 | Joback Calculated Property |
| η | 0.0010361 | Pa×s | 330.82 | Joback Calculated Property |
| η | 0.0005712 | Pa×s | 371.40 | Joback Calculated Property |
| η | 0.0003541 | Pa×s | 411.98 | Joback Calculated Property |
| η | 0.0002391 | Pa×s | 452.57 | Joback Calculated Property |
| η | 0.0001723 | Pa×s | 493.15 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Heptyl tert-pentyl ether.
Sources
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