- InChI
- InChI=1S/C24H27O4P/c1-17(2)21-15-14-20(5)24(16-21)28-29(25,26-22-12-8-6-10-18(22)3)27-23-13-9-7-11-19(23)4/h6-17H,1-5H3
- InChI Key
- VUOFDTVTHHYDMU-UHFFFAOYSA-N
- Formula
- C24H27O4P
- SMILES
-
Cc1ccccc1OP(=O)(Oc1ccccc1C)Oc1
cc(C(C)C)ccc1C - Molecular Weight1
- 410.44
- CAS
- 116402-12-1
- 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 | 0.8812 | Relay (1.0) Calculated Property | |
| ΔfG° | -106.62 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -556.37 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 122.75 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.17 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.88 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.380 | Crippen Calculated Property | |
| McVol | 321.680 | ml/mol | McGowan Calculated Property |
| Pc | 938.34 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 691.00 | K | Relay (1.0) Calculated Property |
| Tc | 1000.40 | K | Relay (1.0) Calculated Property |
| Tfus | 362.95 | K | Relay (1.0) Calculated Property |
| Vc | 1.184 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 5-Isopropyl-2-methylphenyl bis(2-methylphenyl) phosphate.
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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