- InChI
- InChI=1S/C18H25N2O2P/c1-6-22-23(21,19-17-9-7-13(2)11-15(17)4)20-18-10-8-14(3)12-16(18)5/h7-12H,6H2,1-5H3,(H2,19,20,21)
- InChI Key
- MXPYFDYSXONIRX-UHFFFAOYSA-N
- Formula
- C18H25N2O2P
- SMILES
-
CCOP(=O)(Nc1ccc(C)cc1C)Nc1ccc(
C)cc1C - Molecular Weight1
- 332.38
- CAS
- 116401-84-4
- 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 | 0.8229 | Relay (... Calculated Property | |
| ΔfG° | 114.51 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -333.93 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 118.33 | kJ/mol | Relay (... Calculated Property |
| IE | 7.46 | eV | Relay (... Calculated Property |
| log10WS | -4.38 | Relay (... Calculated Property | |
| logPoct/wat | 5.589 | Crippen Calculated Property | |
| McVol | 269.120 | ml/mol | McGowan Calculated Property |
| Pc | 2101.73 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 655.24 | K | Relay (... Calculated Property |
| Tc | 967.54 | K | Relay (... Calculated Property |
| Tfus | 410.72 | K | Relay (... Calculated Property |
| Vc | 0.971 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to Phosphoro diamidic acid, n,n'-bis (2,4-dimethyl phenyl), ethyl ester.
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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