- InChI
- InChI=1S/C36H45O4P/c37-41(38-34-25-13-10-22-31(34)28-16-4-1-5-17-28,39-35-26-14-11-23-32(35)29-18-6-2-7-19-29)40-36-27-15-12-24-33(36)30-20-8-3-9-21-30/h10-15,22-30H,1-9,16-21H2
- InChI Key
- MKOXSOFBQGEZNV-UHFFFAOYSA-N
- Formula
- C36H45O4P
- SMILES
-
O=P(Oc1ccccc1C1CCCCC1)(Oc1cccc
c1C1CCCCC1)Oc1ccccc1C1CCCCC1 - Molecular Weight1
- 572.71
- CAS
- 116402-17-6
- 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).
- 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 | 1.0445 | Relay (1.0) Calculated Property | |
| ΔfG° | 112.00 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -722.90 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 169.24 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.17 | eV | Relay (1.0) Calculated Property |
| log10WS | -9.60 | Relay (1.0) Calculated Property | |
| logPoct/wat | 11.475 | Crippen Calculated Property | |
| McVol | 458.180 | ml/mol | McGowan Calculated Property |
| Tboil | 872.72 | K | Relay (1.0) Calculated Property |
| Tc | 1182.58 | K | Relay (1.0) Calculated Property |
| Tfus | 418.56 | K | Relay (1.0) Calculated Property |
| Vc | 1.681 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Tris(2-cyclohexylphenyl) 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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