- InChI
- InChI=1S/C15H31F2O2PS2/c1-6-9-10-14(7-2)11-15(16,17)22-20(21,18-8-3)19-12-13(4)5/h13-14H,6-12H2,1-5H3
- InChI Key
- OWSWVZBOYCVPHR-UHFFFAOYSA-N
- Formula
- C15H31F2O2PS2
- SMILES
-
CCCCC(CC)CC(F)(F)SP(=S)(OCC)OC
C(C)C - Molecular Weight1
- 376.51
- 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 | 0.6358 | Relay (1.0) Calculated Property | |
| ΔfG° | -505.58 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -1044.13 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 83.27 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.70 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.18 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.853 | Crippen Calculated Property | |
| McVol | 290.650 | ml/mol | McGowan Calculated Property |
| Pc | 1212.34 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 1846.00 | NIST | |
| Tboil | 599.40 | K | Relay (1.0) Calculated Property |
| Tc | 752.28 | K | Relay (1.0) Calculated Property |
| Tfus | 199.51 | K | Relay (1.0) Calculated Property |
| Vc | 1.031 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to O-Ethyl-O-isobutyl-S-(1,1-difluoro-3-ethylheptyl)-dithiophosphate.
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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