- InChI
- InChI=1S/C6H14FO2P/c1-4-6(3)9-10(7,8)5-2/h6H,4-5H2,1-3H3
- InChI Key
- XUDFVXLCFULGLL-UHFFFAOYSA-N
- Formula
- C6H14FO2P
- SMILES
- CCC(C)OP(=O)(F)CC
- Molecular Weight1
- 168.15
- CAS
- 162085-83-8
- Other Names
-
- Ethylphoshonic acid, fluoroanhydride, 1-methylpropyl ester
- Sec-butyl ethylphosphonofluoridate
- s-butyl 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 | 0.4477 | Relay (... Calculated Property | |
| ΔfG° | -436.88 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -757.21 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 51.87 | kJ/mol | Relay (... Calculated Property |
| IE | 9.98 | eV | Relay (... Calculated Property |
| log10WS | -0.91 | Relay (... Calculated Property | |
| logPoct/wat | 2.984 | Crippen Calculated Property | |
| McVol | 129.370 | ml/mol | McGowan Calculated Property |
| Pc | 2710.50 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | [1015.00; 1015.00] |
|
|
| Inp | 1015.00 | NIST | |
| Inp | 1015.00 | NIST | |
| Inp | 1015.00 | NIST | |
| Inp | 1015.00 | NIST | |
| Tboil | 454.06 | K | Relay (... Calculated Property |
| Tc | 601.97 | K | Relay (... Calculated Property |
| Tfus | 196.59 | K | Relay (... Calculated Property |
| Vc | 0.483 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 2-Butyl ethylphosphonofluoridate.
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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