- InChI
- InChI=1S/C11H22O/c1-11(2,3)9-5-7-10(12-4)8-6-9/h9-10H,5-8H2,1-4H3/t9-,10+
- InChI Key
- XMLDPBGRPWQRBE-AOOOYVTPSA-N
- Formula
- C11H22O
- SMILES
- CO[C@H]1CC[C@@H](C(C)(C)C)CC1
- Molecular Weight1
- 170.30
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.3126 | Relay (1.0) Calculated Property | |
| ΔfusH° | 10.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.71 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.36 ± 0.02 | eV | NIST |
| logPoct/wat | 3.238 | Crippen Calculated Property | |
| McVol | 160.860 | ml/mol | McGowan Calculated Property |
| Pc | 2267.57 | kPa | Joback Calculated Property |
| Tboil | 476.53 | K | Relay (1.0) Calculated Property |
| Tc | 699.78 | K | Relay (1.0) Calculated Property |
| Tfus | 260.90 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, 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 | [377.91; 491.71] | J/mol×K | [485.35; 690.96] | 
|
| Cp,gas | 377.91 | J/mol×K | 485.35 | Joback Calculated Property |
| Cp,gas | 399.58 | J/mol×K | 519.62 | Joback Calculated Property |
| Cp,gas | 420.13 | J/mol×K | 553.89 | Joback Calculated Property |
| Cp,gas | 439.59 | J/mol×K | 588.16 | Joback Calculated Property |
| Cp,gas | 457.99 | J/mol×K | 622.42 | Joback Calculated Property |
| Cp,gas | 475.35 | J/mol×K | 656.69 | Joback Calculated Property |
| Cp,gas | 491.71 | J/mol×K | 690.96 | Joback Calculated Property |
| η | [0.0002154; 0.0058275] | Pa×s | [241.52; 485.35] |
|
| η | 0.0058275 | Pa×s | 241.52 | Joback Calculated Property |
| η | 0.0022641 | Pa×s | 282.16 | Joback Calculated Property |
| η | 0.0011160 | Pa×s | 322.80 | Joback Calculated Property |
| η | 0.0006444 | Pa×s | 363.43 | Joback Calculated Property |
| η | 0.0004156 | Pa×s | 404.07 | Joback Calculated Property |
| η | 0.0002903 | Pa×s | 444.71 | Joback Calculated Property |
| η | 0.0002154 | Pa×s | 485.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexane,1-(1,1-dimethylethyl)-4-methoxy-cis-.
Sources
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