- InChI
- InChI=1S/C12H27O4P/c1-5-9-10-12(6-2)11-16-17(13,14-7-3)15-8-4/h12H,5-11H2,1-4H3
- InChI Key
- KSBHGUFPVHFCKX-UHFFFAOYSA-N
- Formula
- C12H27O4P
- SMILES
- CCCCC(CC)COP(=O)(OCC)OCC
- Molecular Weight1
- 266.31
- CAS
- 88795-49-7
- 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).
- 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 | 0.6676 | Relay (1.0) Calculated Property | |
| ΔfG° | -393.03 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -961.15 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 80.62 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.77 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.93 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.401 | Crippen Calculated Property | |
| McVol | 223.880 | ml/mol | McGowan Calculated Property |
| Pc | 1666.54 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 568.10 | K | Relay (1.0) Calculated Property |
| Tc | 687.16 | K | Relay (1.0) Calculated Property |
| Tfus | 184.96 | K | Relay (1.0) Calculated Property |
| Vc | 0.840 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Phosphoric acid, diethyl 2-ethylhexyl 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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