- InChI
- InChI=1S/C11H11F2NO2/c12-8-2-1-3-9(13)10(8)11(15)14-4-6-16-7-5-14/h1-3H,4-7H2
- InChI Key
- BMYZPMBQQKTEHE-UHFFFAOYSA-N
- Formula
- C11H11F2NO2
- SMILES
- O=C(c1c(F)cccc1F)N1CCOCC1
- Molecular Weight1
- 227.21
- 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 | 0.5401 | Relay (... Calculated Property | |
| ΔfG° | -291.31 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -551.89 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 74.83 | kJ/mol | Relay (... Calculated Property |
| IE | 9.32 | eV | Relay (... Calculated Property |
| log10WS | -1.79 | Relay (... Calculated Property | |
| logPoct/wat | 1.437 | Crippen Calculated Property | |
| McVol | 152.190 | ml/mol | McGowan Calculated Property |
| Pc | 2652.26 | kPa | Relay (... Calculated Property ⚠️ |
| Inp | 1614.00 | NIST | |
| Tboil | 577.96 | K | Relay (... Calculated Property |
| Tc | 803.23 | K | Relay (... Calculated Property |
| Tfus | 335.59 | K | Relay (... Calculated Property |
| Vc | 0.555 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 2,6-Difluorobenzoic acid, morpholide.
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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