- InChI
- InChI=1S/C6H12/c1-6(2)4-3-5-6/h3-5H2,1-2H3
- InChI Key
- OFZYBEBWCZBCPM-UHFFFAOYSA-N
- Formula
- C6H12
- SMILES
- CC1(C)CCC1
- Molecular Weight1
- 84.16
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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° | 42.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -85.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 1.03 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 27.88 | kJ/mol | Joback Calculated Property |
| log10WS | -1.99 | Crippen Calculated Property | |
| logPoct/wat | 2.196 | Crippen Calculated Property | |
| McVol | 84.540 | ml/mol | McGowan Calculated Property |
| Pc | 3935.71 | kPa | Joback Calculated Property |
| Tboil | 347.93 | K | Joback Calculated Property |
| Tc | 543.37 | K | Joback Calculated Property |
| Tfus | 195.70 | K | Joback Calculated Property |
| Vc | 0.319 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [138.32; 209.97] | J/mol×K | [347.93; 543.37] | 
|
| Cp,gas | 138.32 | J/mol×K | 347.93 | Joback Calculated Property |
| Cp,gas | 152.73 | J/mol×K | 380.50 | Joback Calculated Property |
| Cp,gas | 166.04 | J/mol×K | 413.08 | Joback Calculated Property |
| Cp,gas | 178.32 | J/mol×K | 445.65 | Joback Calculated Property |
| Cp,gas | 189.68 | J/mol×K | 478.22 | Joback Calculated Property |
| Cp,gas | 200.20 | J/mol×K | 510.79 | Joback Calculated Property |
| Cp,gas | 209.97 | J/mol×K | 543.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,1-DIMETHYLCYCLOBUTANE.
Sources
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