- InChI
- InChI=1S/C24H35O4P/c1-8-22(9-17(2)3)16-26-29(25,27-23-12-18(4)10-19(5)13-23)28-24-14-20(6)11-21(7)15-24/h10-15,17,22H,8-9,16H2,1-7H3
- InChI Key
- SNMYVUCYGMKUPF-UHFFFAOYSA-N
- Formula
- C24H35O4P
- SMILES
-
CCC(COP(=O)(Oc1cc(C)cc(C)c1)Oc
1cc(C)cc(C)c1)CC(C)C - Molecular Weight1
- 418.51
- CAS
- 116402-05-2
- 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 | 0.9635 | Relay (... Calculated Property | |
| ΔfG° | -231.16 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -814.66 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 116.57 | kJ/mol | Relay (... Calculated Property |
| IE | 7.99 | eV | Relay (... Calculated Property |
| log10WS | -7.30 | Relay (... Calculated Property | |
| logPoct/wat | 7.575 | Crippen Calculated Property | |
| McVol | 345.440 | ml/mol | McGowan Calculated Property |
| Pc | 820.80 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 692.56 | K | Relay (... Calculated Property |
| Tc | 929.00 | K | Relay (... Calculated Property |
| Tfus | 285.49 | K | Relay (... Calculated Property |
| Vc | 1.265 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Bis(3,5-dimethylphenyl)-2-ethyl-4-methylpentyl 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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