- InChI
- InChI=1S/C18H21O3P/c1-5-21-22(20,16-9-7-6-8-10-16)18(19)17-14(3)11-13(2)12-15(17)4/h6-12H,5H2,1-4H3
- InChI Key
- ZMDDERVSCYEKPQ-UHFFFAOYSA-N
- Formula
- C18H21O3P
- SMILES
-
CCOP(=O)(C(=O)c1c(C)cc(C)cc1C)
c1ccccc1 - Molecular Weight1
- 316.33
- 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.
- 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 | 0.6931 | Relay (1.0) Calculated Property | |
| ΔfG° | -124.20 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -396.37 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 95.91 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.81 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.23 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.392 | Crippen Calculated Property | |
| McVol | 250.730 | ml/mol | McGowan Calculated Property |
| Pc | 1473.64 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 2266.00 | NIST | |
| Tboil | 652.67 | K | Relay (1.0) Calculated Property |
| Tc | 892.85 | K | Relay (1.0) Calculated Property |
| Tfus | 323.44 | K | Relay (1.0) Calculated Property |
| Vc | 0.902 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Lucirin TPO liquid (Ethyl-2, 4, 6 trimethylbenzoylphenyl phosphinate.
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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