- InChI
- InChI=1S/C5H12FO2P/c1-4-9(6,7)8-5(2)3/h5H,4H2,1-3H3
- InChI Key
- KXKAXOZWSFAJTG-UHFFFAOYSA-N
- Formula
- C5H12FO2P
- SMILES
- CCP(=O)(F)OC(C)C
- Molecular Weight1
- 154.12
- CAS
- 1189-87-3
- Other Names
-
- Ethylphosphonofluoridic acid isopropyl ester
- Isopropoxy-ethylphosphonofluoridate
- Isopropoxy-ethyl-phosphoryl fluoride
- Phoshonofluoridic acid, ethyl-, isopropyl ester
- Ethylphoshonic acid, fluoroanhydride-, isopropyl ester
- Isopropyl ethylphosphonofluoridate
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.4094 | Relay (1.0) Calculated Property | |
| ΔfG° | -437.46 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -730.77 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 46.76 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.06 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.70 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.594 | Crippen Calculated Property | |
| McVol | 115.280 | ml/mol | McGowan Calculated Property |
| Pc | 2794.63 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | [906.90; 907.00] |
|
|
| Inp | 907.00 | NIST | |
| Inp | 906.90 | NIST | |
| Inp | 907.00 | NIST | |
| Tboil | 431.22 | K | Relay (1.0) Calculated Property |
| Tc | 576.09 | K | Relay (1.0) Calculated Property |
| Tfus | 208.33 | K | Relay (1.0) Calculated Property |
| Vc | 0.438 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Phosphonofluoridic acid, ethyl-, isopropyl ester.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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