- InChI
- InChI=1S/C5H8ClIO/c6-1-5(2-7)3-8-4-5/h1-4H2
- InChI Key
- AAHVBCSCIJYASL-UHFFFAOYSA-N
- Formula
- C5H8ClIO
- SMILES
- ClCC1(CI)COC1
- Molecular Weight1
- 246.47
- 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).
- 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° | -5.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -135.52 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.93 | kJ/mol | Joback Calculated Property |
| log10WS | -1.76 | Crippen Calculated Property | |
| logPoct/wat | 1.677 | Crippen Calculated Property | |
| McVol | 114.380 | ml/mol | McGowan Calculated Property |
| Pc | 4077.71 | kPa | Joback Calculated Property |
| Inp | 1249.00 | NIST | |
| Tboil | 482.57 | K | Joback Calculated Property |
| Tc | 728.91 | K | Joback Calculated Property |
| Tfus | 298.98 | K | Joback Calculated Property |
| Vc | 0.420 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [204.11; 253.52] | J/mol×K | [482.57; 728.91] | 
|
| Cp,gas | 204.11 | J/mol×K | 482.57 | Joback Calculated Property |
| Cp,gas | 214.47 | J/mol×K | 523.63 | Joback Calculated Property |
| Cp,gas | 223.72 | J/mol×K | 564.68 | Joback Calculated Property |
| Cp,gas | 232.07 | J/mol×K | 605.74 | Joback Calculated Property |
| Cp,gas | 239.69 | J/mol×K | 646.80 | Joback Calculated Property |
| Cp,gas | 246.78 | J/mol×K | 687.85 | Joback Calculated Property |
| Cp,gas | 253.52 | J/mol×K | 728.91 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Oxetane, 3-chloromethyl-3-iodomethyl.
Sources
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