- InChI
- InChI=1S/C3H2ClF5O/c4-1(3(7,8)9)10-2(5)6/h1-2H
- InChI Key
- PIWKPBJCKXDKJR-UHFFFAOYSA-N
- Formula
- C3H2ClF5O
- SMILES
- FC(F)OC(Cl)C(F)(F)F
- Molecular Weight1
- 184.49
- CAS
- 26675-46-7
- Other Names
-
- Ethane, 2-chloro-2-(difluoromethoxy)-1,1,1-trifluoro-
- Ether, 1-chloro-2,2,2-trifluoroethyl difluoromethyl
- Forane
- 1-Chloro-2,2,2-trifluoroethyl difluoromethyl ether
- Aerrane
- 2-Chloro-2-(difluoromethoxy)-1,1,1-trifluoroethane
- Compd 469
- Compound 469
- Forene
- Ethane, 1-chloro-1-(difluoromethoxy)-2,2,2-trifluoro-
- IsoFlo
- R-E 235dal
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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° | -1118.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1253.07 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 22.91 | kJ/mol | Joback Calculated Property |
| log10WS | -2.40 | Crippen Calculated Property | |
| logPoct/wat | 2.353 | Crippen Calculated Property | |
| McVol | 80.090 | ml/mol | McGowan Calculated Property |
| Pc | 3046.00 ± 5.00 | kPa | NIST |
| Inp | [454.00; 454.00] |
|
|
| Inp | 454.00 | NIST | |
| Inp | 454.00 | NIST | |
| Inp | 454.00 | NIST | |
| Tboil | 321.60 | K | NIST |
| Tc | 467.80 ± 0.02 | K | NIST |
| Tfus | 151.09 | K | Joback Calculated Property |
| Vc | 0.338 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [149.38; 181.82] | J/mol×K | [320.13; 465.94] |
|
| Cp,gas | 149.38 | J/mol×K | 320.13 | Joback Calculated Property |
| Cp,gas | 155.44 | J/mol×K | 344.43 | Joback Calculated Property |
| Cp,gas | 161.23 | J/mol×K | 368.73 | Joback Calculated Property |
| Cp,gas | 166.76 | J/mol×K | 393.04 | Joback Calculated Property |
| Cp,gas | 172.03 | J/mol×K | 417.34 | Joback Calculated Property |
| Cp,gas | 177.05 | J/mol×K | 441.64 | Joback Calculated Property |
| Cp,gas | 181.82 | J/mol×K | 465.94 | Joback Calculated Property |
| ΔvapH | [31.70; 31.90] | kJ/mol | [297.50; 312.00] |
|
| ΔvapH | 31.90 | kJ/mol | 297.50 | NIST |
| ΔvapH | 31.70 | kJ/mol | 312.00 | NIST |
Similar Compounds
Find more compounds similar to Isoflurane.
Sources
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