- InChI
- InChI=1S/C9H13O5P/c1-11-8-4-6-9(7-5-8)14-15(10,12-2)13-3/h4-7H,1-3H3
- InChI Key
- PHQVYYOBMMIRNS-UHFFFAOYSA-N
- Formula
- C9H13O5P
- SMILES
- COc1ccc(OP(=O)(OC)OC)cc1
- Molecular Weight1
- 232.17
- CAS
- 7357-14-4
- Other Names
-
- Dimethyl 4-methoxyphenyl phosphate
- 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.
- I : 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 | 0.6198 | Relay (1.0) Calculated Property | |
| ΔfG° | -395.95 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -773.37 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 79.96 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.35 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.60 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.475 | Crippen Calculated Property | |
| McVol | 163.720 | ml/mol | McGowan Calculated Property |
| Pc | 2378.93 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 1637.00 | NIST | |
| I | [2350.00; 2350.00] |
|
|
| I | 2350.00 | NIST | |
| I | 2350.00 | NIST | |
| Tboil | 584.95 | K | Relay (1.0) Calculated Property |
| Tc | 761.40 | K | Relay (1.0) Calculated Property |
| Tfus | 296.75 | K | Relay (1.0) Calculated Property |
| Vc | 0.622 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Phosphoric acid, 4-methoxyphenyl dimethyl 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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