- InChI
- InChI=1S/C14H15O3P/c15-18(16-11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10,15H,11-12H2
- InChI Key
- DYUGVWSETOTNKQ-UHFFFAOYSA-N
- Formula
- C14H15O3P
- SMILES
- OP(OCc1ccccc1)OCc1ccccc1
- Molecular Weight1
- 262.24
- CAS
- 17176-77-1
- Other Names
-
- Phosphonic acid dibenzyl ester
- Phosphonic acid, bis(phenylmethyl) ester
- Phosphorous acid, bis(phenylmethyl) ester
- dibenzyl phosphonate
- 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 | 0.7450 | Relay (1.0) Calculated Property | |
| ΔfG° | 43.61 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -193.91 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 113.62 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.93 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.36 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.639 | Crippen Calculated Property | |
| McVol | 198.670 | ml/mol | McGowan Calculated Property |
| Pc | 2687.96 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 618.02 | K | Relay (1.0) Calculated Property |
| Tc | 876.42 | K | Relay (1.0) Calculated Property |
| Tfus | 315.95 | K | Relay (1.0) Calculated Property |
| Vc | 0.734 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Dibenzyl phosphite.
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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