- InChI
- InChI=1S/C30H39O4P/c1-19(2)25-13-10-22(7)16-28(25)32-35(31,33-29-17-23(8)11-14-26(29)20(3)4)34-30-18-24(9)12-15-27(30)21(5)6/h10-21H,1-9H3
- InChI Key
- PWNWNMQFFQVYNB-UHFFFAOYSA-N
- Formula
- C30H39O4P
- SMILES
-
Cc1ccc(C(C)C)c(OP(=O)(Oc2cc(C)
ccc2C(C)C)Oc2cc(C)ccc2C(C)C)c1 - Molecular Weight1
- 494.60
- CAS
- 22291-52-7
- 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 | 1.0560 | Relay (1.0) Calculated Property | |
| ΔfG° | -107.09 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -714.07 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 136.10 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.89 | eV | Relay (1.0) Calculated Property |
| log10WS | -8.80 | Relay (1.0) Calculated Property | |
| logPoct/wat | 9.627 | Crippen Calculated Property | |
| McVol | 406.220 | ml/mol | McGowan Calculated Property |
| Pc | 170.20 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 724.33 | K | Relay (1.0) Calculated Property |
| Tc | 1033.67 | K | Relay (1.0) Calculated Property |
| Tfus | 410.72 | K | Relay (1.0) Calculated Property |
| Vc | 1.498 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Tris(2-isopropyl-5-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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