- InChI
- InChI=1S/C10H14NO6P/c1-3-15-18(14,16-4-2)17-10-7-5-6-9(8-10)11(12)13/h5-8H,3-4H2,1-2H3
- InChI Key
- VXPBWHFHOQMMHT-UHFFFAOYSA-N
- Formula
- C10H14NO6P
- SMILES
-
CCOP(=O)(OCC)Oc1cccc([N+](=O)[
O-])c1 - Molecular Weight1
- 275.19
- CAS
- 4532-06-3
- 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.
- I : 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 | 0.7183 | Relay (1.0) Calculated Property | |
| ΔfG° | -257.78 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -673.11 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 91.00 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.53 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.46 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.155 | Crippen Calculated Property | |
| McVol | 189.360 | ml/mol | McGowan Calculated Property |
| Pc | 2117.65 | kPa | Relay (1.0-beta) Calculated Property |
| Inp | 1880.00 | NIST | |
| I | [2820.00; 2820.00] |
|
|
| I | 2820.00 | NIST | |
| I | 2820.00 | NIST | |
| Tboil | 607.11 | K | Relay (1.0) Calculated Property |
| Tc | 812.48 | K | Relay (1.0) Calculated Property |
| Tfus | 283.07 | K | Relay (1.0) Calculated Property |
| Vc | 0.702 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Diethyl,3-nitrophenyl 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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