- InChI
- InChI=1S/C2H6O/c1-3-2/h1-2H3/i1D3,2D3
- InChI Key
- LCGLNKUTAGEVQW-WFGJKAKNSA-N
- Formula
- C2D6O
- SMILES
- COC
- Molecular Weight1
- 52.11
- CAS
- 17222-37-6
- 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).
- 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 | 0.2003 | Relay (1.0) Calculated Property | |
| ΔfG° | -139.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -166.77 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 2.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 18.73 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.83 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 0.263 | Crippen Calculated Property | |
| McVol | 44.910 | ml/mol | McGowan Calculated Property |
| Pc | 4910.80 | kPa | Joback Calculated Property |
| Tboil | 245.65 | K | Relay (1.0) Calculated Property |
| Tc | 396.40 | K | Relay (1.0) Calculated Property |
| Tfus | 134.39 | K | Relay (1.0) Calculated Property |
| Vc | 0.159 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [62.61; 83.96] | J/mol×K | [267.78; 428.17] | 
|
| Cp,gas | 62.61 | J/mol×K | 267.78 | Joback Calculated Property |
| Cp,gas | 66.22 | J/mol×K | 294.51 | Joback Calculated Property |
| Cp,gas | 69.82 | J/mol×K | 321.24 | Joback Calculated Property |
| Cp,gas | 73.40 | J/mol×K | 347.98 | Joback Calculated Property |
| Cp,gas | 76.95 | J/mol×K | 374.71 | Joback Calculated Property |
| Cp,gas | 80.47 | J/mol×K | 401.44 | Joback Calculated Property |
| Cp,gas | 83.96 | J/mol×K | 428.17 | Joback Calculated Property |
| η | [0.0001395; 0.0013866] | Pa×s | [134.53; 267.78] |
|
| η | 0.0013866 | Pa×s | 134.53 | Joback Calculated Property |
| η | 0.0007211 | Pa×s | 156.74 | Joback Calculated Property |
| η | 0.0004410 | Pa×s | 178.95 | Joback Calculated Property |
| η | 0.0003007 | Pa×s | 201.15 | Joback Calculated Property |
| η | 0.0002212 | Pa×s | 223.36 | Joback Calculated Property |
| η | 0.0001721 | Pa×s | 245.57 | Joback Calculated Property |
| η | 0.0001395 | Pa×s | 267.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (CD3)2O.
Sources
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